SMILES,Molecule Name,Target Name,Type,label,LF_score,GN_score,DD_score, RMSD_Energy
NC(=O)CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL472542_active,WEE1,Active,1.0,-11.5113,-12.65,0.73,-27.57755073204936
O=C(CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O)NS(=O)(=O)c1ccccc1,CHEMBL515352_active,WEE1,Active,1.0,-12.0124,-13.16,-0.84,-16.960839721879143
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCO,CHEMBL471163_active,WEE1,Active,1.0,-12.4727,-12.5,0.44,-29.952106099384544
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCO,CHEMBL471157_active,WEE1,Active,1.0,-12.0705,-12.56,0.26,-26.90780203456477
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCO,CHEMBL411662_active,WEE1,Active,1.0,-11.7116,-12.49,0.87,-30.30069079320037
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CC[S+]([O-])n1ccnn1,CHEMBL486517_active,WEE1,Active,1.0,-10.918,-12.45,-0.42,-22.92823263172857
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CC[S+]([O-])c1nnc[nH]1,CHEMBL472208_active,WEE1,Active,1.0,-11.553,-12.7,-0.03,-23.64577362639889
O=C(O)CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL459889_active,WEE1,Active,1.0,-11.3669,-12.67,-0.0,-25.23625602321065
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3ccc(O)cc3c21,CHEMBL379975_active,WEE1,Active,1.0,-10.5596,-13.17,0.7,-30.14767976447476
Cn1c2cc(C(=O)NCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL272267_active,WEE1,Active,1.0,-12.142,-12.72,-0.1,-23.404375407837392
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(OCCCN3CCOCC3)cc2n1CCO,CHEMBL271715_active,WEE1,Active,1.0,-12.4158,-16.1,0.55,-24.01289574871003
Cn1c2cc(C(=O)NCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL472689_active,WEE1,Active,1.0,-11.4559,-12.68,-0.26,-17.16938742454437
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCc1nnn[nH]1,CHEMBL471329_active,WEE1,Active,1.0,-11.652,-13.34,0.46,-20.29396830114383
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2c(n1CCO)=CC(OCCCn1cccc1)C(O)(O)C=2,CHEMBL469822_active,WEE1,Active,1.0,-12.4529,-15.3,-0.35,-24.59176134501675
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(CCCCN3CCOCC3)cc2n1CCO,CHEMBL258067_active,WEE1,Active,1.0,-12.3007,-16.23,0.31,-21.730376183652933
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCS(=O)(=O)c1nnc[nH]1,CHEMBL472209_active,WEE1,Active,1.0,-11.3534,-12.95,-0.44,-21.265688009759856
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCS(=O)(=O)n1ccnn1,CHEMBL487757_active,WEE1,Active,1.0,-11.6116,-12.63,-1.37,-18.908536137112872
Cn1c2cc(SCCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL404335_active,WEE1,Active,1.0,-12.0124,-11.73,0.11,-20.959141613533987
Cn1c2cc(SCCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL474714_active,WEE1,Active,1.0,-12.1088,-12.03,-0.51,-21.50620197553321
NC(=O)CCn1c2ccc(O)cc2c2c3c(ccc21)C(=O)NC3=O,CHEMBL484808_active,WEE1,Active,1.0,-8.75674,-10.52,-0.02,-16.83507378882343
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCc1nnn[nH]1,CHEMBL512342_active,WEE1,Active,1.0,-11.7632,-13.48,0.4,-23.32649861343052
O=C(O)CCn1c2ccc(O)cc2c2c3c(ccc21)C(=O)NC3=O,CHEMBL520182_active,WEE1,Active,1.0,-8.41483,-10.55,0.67,-22.39523732727132
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(OCCCN3CCCC3)cc2n1CCO,CHEMBL270021_active,WEE1,Active,1.0,-12.2627,-15.95,0.22,-28.225965729151905
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(CCCCN3CCCC3)cc2n1CCO,CHEMBL255565_active,WEE1,Active,1.0,-12.008,-16.13,0.18,-24.61966954871385
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCSc1nnc[nH]1,CHEMBL513079_active,WEE1,Active,1.0,-11.6417,-12.5,-0.04,-22.08669405727136
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(OCCCn3cccc3)cc2n1CCO,CHEMBL474111_active,WEE1,Active,1.0,-11.852,-11.43,-0.28,-24.43805471154228
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(CCCCn3cccc3)cc2n1CCO,CHEMBL469612_active,WEE1,Active,1.0,-11.3689,-11.6,-0.52,-27.11099870049151
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCSn1ccnn1,CHEMBL521200_active,WEE1,Active,1.0,-11.5949,-12.3,0.15,-21.46423288654445
O=C1NC(=O)c2c1ccc1c2c2cc(O)ccc2n1CCO,CHEMBL475325_active,WEE1,Active,1.0,-8.56533,-10.32,0.82,-19.727726052423773
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3cc(OCCCN4CCOCC4)c(O)cc3c21,CHEMBL256480_active,WEE1,Active,1.0,-12.0304,-11.99,-0.74,-10.589301483770097
Cn1c2cc(CCCCN3CCOCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL438566_active,WEE1,Active,1.0,-11.8873,-12.27,0.27,-17.312171696066656
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(CCCC(=O)O)cc3)nc21,CHEMBL113070_active,WEE1,Active,1.0,-11.0659,-9.72,-0.11,-21.210947113887816
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1oc3ccc(O)cc3c21,CHEMBL386398_active,WEE1,Active,1.0,-10.1255,-13.15,0.31,-24.76765669032377
Cn1c2cc([S+]([O-])CCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL270866_active,WEE1,Active,1.0,-11.9555,-11.78,-0.18,-16.506402292137633
Cn1c2cc([S+]([O-])CCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL475524_active,WEE1,Active,1.0,-11.6155,-11.96,-0.58,-16.810489732155418
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3cc(OCCCN4CCCC4)c(O)cc3c21,CHEMBL271071_active,WEE1,Active,1.0,-11.5549,-11.82,0.33,-20.024638973105294
Cn1c2cc(CCCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL271084_active,WEE1,Active,1.0,-11.7937,-12.11,-0.0,-19.03197545332569
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3cc(OCCCn4cccc4)c(O)cc3c21,CHEMBL485638_active,WEE1,Active,1.0,-11.362,-11.64,-0.65,-16.77667647985744
Cn1c2cc(CCCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL488783_active,WEE1,Active,1.0,-11.4727,-12.15,-0.24,-25.684360057064936
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3cc(CCCCN4CCOCC4)c(O)cc3c21,CHEMBL403679_active,WEE1,Active,1.0,-11.7308,-11.65,0.22,-16.41871894336866
O=C1NC(=O)c2c1c(-c1cc[nH]c1)cc1[nH]c3ccc(O)cc3c21,CHEMBL213422_active,WEE1,Active,1.0,-9.11139,-11.47,1.09,-8.905822873146997
Cn1c(=O)c(-c2c(Cl)cc(O)cc2Cl)cc2cnc(Nc3ccc(OCCCC(=O)O)cc3)nc21,CHEMBL181314_active,WEE1,Active,1.0,-11.9694,-9.39,-0.11,-19.40661448546069
Cn1c(=O)c(-c2c(Cl)ccc(O)c2Cl)cc2cnc(Nc3ccc(OCCCC(=O)O)cc3)nc21,CHEMBL366922_active,WEE1,Active,1.0,-12.4154,-9.77,-0.5,-18.17142416204668
O=C1NC(=O)c2c1c(-c1ccsc1)cc1[nH]c3ccc(O)cc3c21,CHEMBL377839_active,WEE1,Active,1.0,-10.1076,-12.15,1.05,-25.513240008267687
Cn1c2cc(S(=O)(=O)NCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL514192_active,WEE1,Active,1.0,-11.2322,-12.18,-0.9,-15.43556569916952
Cn1c2cc(S(=O)(=O)NCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL402093_active,WEE1,Active,1.0,-12.3804,-11.92,0.36,-16.903293964052818
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3cc(CCCCN4CCCC4)c(O)cc3c21,CHEMBL272946_active,WEE1,Active,1.0,-11.5546,-11.84,-0.58,-19.969317659601867
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3cc(CCCCn4cccc4)c(O)cc3c21,CHEMBL518903_active,WEE1,Active,1.0,-11.1281,-11.89,-0.53,-22.670356529325616
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCC(=O)n1ccnc1,CHEMBL530112_active,WEE1,Active,1.0,-11.4272,-12.78,-0.99,-22.106927391498804
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCn1ccnc1,CHEMBL486665_active,WEE1,Active,1.0,-11.445,-12.57,0.18,-21.561738018627377
Cn1c2cc(OCCCN3CCOCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL272351_active,WEE1,Active,1.0,-11.9011,-12.12,-0.56,-10.681542932709185
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCC(=O)n1ccnc1,CHEMBL483786_active,WEE1,Active,1.0,-12.5273,-12.63,-1.19,-20.51656236493611
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCn1ccnc1,CHEMBL452829_active,WEE1,Active,1.0,-12.3321,-14.91,-0.02,-24.090413647767257
CN1CCN(CCCn2c3ccc(O)cc3c3c4c(c(-c5c(Cl)cccc5Cl)cc32)C(=O)NC4=O)CC1,CHEMBL452078_active,WEE1,Active,1.0,-13.2227,-12.78,-0.08,-17.87354871049439
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCN1CCOCC1,CHEMBL486828_active,WEE1,Active,1.0,-12.4932,-12.45,-0.33,-21.011749521039054
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCN1CCOCC1,CHEMBL529669_active,WEE1,Active,1.0,-11.9313,-12.91,0.64,-20.18009689504636
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCC(=O)N1CCOCC1,CHEMBL483611_active,WEE1,Active,1.0,-12.8475,-12.89,-1.0,-24.5505082865694
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCC(=O)N1CCOCC1,CHEMBL486100_active,WEE1,Active,1.0,-11.8718,-13.14,-0.08,-21.666925990600777
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCNc1ccccc1,CHEMBL461134_active,WEE1,Active,1.0,-12.6569,-12.53,-0.52,-19.99268184108351
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(CCCC4N=NN=N4)cc3)nc21,CHEMBL178510_active,WEE1,Active,1.0,-10.2659,-10.65,-0.68,-14.36162674065038
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCC(=O)N1CCOCC1,CHEMBL519212_active,WEE1,Active,1.0,-11.7707,-12.89,-0.03,-16.538017526177352
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCN1CCOCC1,CHEMBL486661_active,WEE1,Active,1.0,-11.3915,-12.72,0.3,-17.334545934718246
Cn1c(=O)c(-c2c(Cl)ccc(O)c2Cl)cc2cnc(Nc3ccccc3)nc21,CHEMBL181233_active,WEE1,Active,1.0,-10.3313,-10.56,0.19,-16.82956697482013
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCNc1ccccc1,CHEMBL460079_active,WEE1,Active,1.0,-11.8322,-12.44,-0.85,-17.721949115473755
Cn1c2cc(OCCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL255427_active,WEE1,Active,1.0,-11.9876,-12.0,0.26,-21.11242608685497
Cn1c2cc(OCCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL472687_active,WEE1,Active,1.0,-11.4284,-12.05,-0.57,-22.663022216262487
O=C1NC(=O)c2c1c(-c1ccccc1)cc1sc3ccc(O)cc3c21,CHEMBL378756_active,WEE1,Active,1.0,-10.1864,-12.59,0.95,-26.34197240048814
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cc(O)cc4Cl)c(=O)n(C)c3n2)cc1,CHEMBL540206_active,WEE1,Active,1.0,-11.6122,-8.66,-0.68,-16.123069143784967
CN1CCN(CCCn2c3ccc(O)cc3c3c4c(c(-c5ccccc5Cl)cc32)C(=O)NC4=O)CC1,CHEMBL508412_active,WEE1,Active,1.0,-12.3053,-12.72,0.09,-15.62092543331179
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(OCCCC(=O)O)cc3)nc21,CHEMBL181285_active,WEE1,Active,1.0,-10.4175,-9.29,-0.6,-16.9757322127787
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCC(=O)n1ccnc1,CHEMBL520537_active,WEE1,Active,1.0,-11.6332,-13.14,-1.01,-19.405164043046057
O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCn1ccnc1,CHEMBL529897_active,WEE1,Active,1.0,-11.4844,-12.73,0.32,-23.84252885978095
O=C1NC(=O)c2c1c(-c1ccccc1)cc1c2c2cc(O)ccc2n1CCCNc1ccccc1,CHEMBL452079_active,WEE1,Active,1.0,-10.8265,-11.91,0.13,-19.14061485269553
O=C1NC(=O)c2c1ccc1c2c2cc(O)ccc2n1CCCNc1ccccc1,CHEMBL483800_active,WEE1,Active,1.0,-8.92467,-10.64,-0.6,-12.097718056684576
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(CCCC(=O)OCCN4CCOCC4)cc3)nc21,CHEMBL362862_active,WEE1,Active,1.0,-10.8596,-9.1,-1.22,-11.966987846767418
O=C1NC(=O)c2c1ccc1[nH]c3ccc(O)cc3c21,CHEMBL209907_active,WEE1,Active,1.0,-7.65308,-10.65,0.81,-8.633392557787952
O=C1NC(=O)c2c1c(-c1ccccc1)cc1c2c2cc(O)ccc2n1CCCn1ccnc1,CHEMBL519238_active,WEE1,Active,1.0,-10.3573,-12.1,0.65,-17.884350176057335
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCN1CCOCC1,CHEMBL520071_active,WEE1,Active,1.0,-12.6938,-15.06,0.63,-23.40080300073531
O=C1NC(=O)c2c1ccc1c2c2cc(O)ccc2n1CCCC(=O)n1ccnc1,CHEMBL521065_active,WEE1,Active,1.0,-9.10603,-10.2,-1.58,-10.042683781761232
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCC(=O)N1CCOCC1,CHEMBL486101_active,WEE1,Active,1.0,-12.6906,-13.17,-0.56,-14.390049739847225
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCn1ccnc1,CHEMBL508294_active,WEE1,Active,1.0,-12.3038,-12.76,-1.12,-24.12358676215848
O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCC(=O)n1ccnc1,CHEMBL486728_active,WEE1,Active,1.0,-12.2151,-5.72,-0.59,-7.5073452949026365
O=C1NC(=O)c2c1c(-c1cccs1)cc1[nH]c3ccc(O)cc3c21,CHEMBL209486_active,WEE1,Active,1.0,-10.23,-12.14,0.94,-24.47827753602281
O=C1NC(=O)c2c1c(-c1ccccc1)cc1c2c2cc(O)ccc2n1CCN1CCOCC1,CHEMBL521051_active,WEE1,Active,1.0,-10.9884,-12.43,0.21,-20.270301155856423
O=C1NC(=O)c2c1ccc1c2c2cc(O)ccc2n1CCC(=O)N1CCOCC1,CHEMBL488572_active,WEE1,Active,1.0,-8.88137,-10.69,-0.38,-13.889032341481895
Cn1c2ccc(O)cc2c2c3c(ccc21)C(=O)NC3=O,CHEMBL507613_active,WEE1,Active,1.0,-7.79842,-10.91,0.74,-18.21342134152686
Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(Nc3ccc(CCCC(=O)OCCN4CCCCC4)cc3)nc21,CHEMBL362692_active,WEE1,Active,1.0,-10.8157,-8.87,-1.21,-12.245180624463414
Cn1c2cc(S(=O)(=O)CCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL520984_active,WEE1,Active,1.0,-11.5821,-11.97,-0.19,-17.88959040977442
Cn1c2cc(S(=O)(=O)CCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O,CHEMBL257857_active,WEE1,Active,1.0,-12.3035,-12.06,-0.39,-16.93560931943572
CN(C)CCNC(=O)CCn1c2ccc(O)cc2c2c3c(ccc21)C(=O)NC3=O,CHEMBL483801_active,WEE1,Active,1.0,-8.84951,-9.79,-0.64,-14.364592194659076
O=C1NC(=O)c2c1c(-c1ccc[nH]1)cc1[nH]c3ccc(O)cc3c21,CHEMBL379149_active,WEE1,Active,1.0,-8.94972,-11.38,1.09,-8.848807285772326
O=C1NC(=O)c2c1ccc1c2c2cc(O)ccc2n1CCC(=O)n1ccnc1,CHEMBL488571_active,WEE1,Active,1.0,-8.8372,-10.9,-0.01,-10.32104192413026
O=C1NC(=O)c2c1c(-c1ccccc1)cc1c2c2cc(O)ccc2n1CCn1ccnc1,CHEMBL488899_active,WEE1,Active,1.0,-10.4488,-12.39,0.4,-19.51910211947184
O=C1NC(=O)c2c1ccc1c2c2cc(O)ccc2n1CCCC(=O)N1CCOCC1,CHEMBL520049_active,WEE1,Active,1.0,-9.26454,-10.91,-0.69,-11.14240094269072
O=C1NC(=O)c2c1c(-c1ccccc1)cc1c2c2cc(O)ccc2n1CCCN1CCOCC1,CHEMBL510668_active,WEE1,Active,1.0,-10.8004,-12.15,0.52,-22.07508601425067
CN1CCN(CCCn2c3ccc(O)cc3c3c4c(c(-c5ccccc5)cc32)C(=O)NC4=O)CC1,CHEMBL453347_active,WEE1,Active,1.0,-10.8326,-12.29,0.43,-14.848830052173955
CN1CCN(CCCn2c3ccc(O)cc3c3c4c(ccc32)C(=O)NC4=O)CC1,CHEMBL483953_active,WEE1,Active,1.0,-9.19459,-10.71,0.31,-13.93613138863046
O=C1NC(=O)c2c1c(-c1ccccc1)cc1oc3ccc(O)cc3c21,CHEMBL441695_active,WEE1,Active,1.0,-9.08775,-12.55,0.83,-24.821241741742583
O=C1NC(=O)c2c1c(-c1ccccc1-c1ccccc1)cc1[nH]c3ccc(O)cc3c21,CHEMBL379346_active,WEE1,Active,1.0,-8.31179,-13.19,-0.45,-10.03911400665066
O=C1NC(=O)c2c1c(-c1cccnc1)cc1[nH]c3ccc(O)cc3c21,CHEMBL214172_active,WEE1,Active,1.0,-9.18641,-12.24,0.94,-21.833524453932817
CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C,CHEMBL607707_active,WEE1,Active,1.0,-10.238,-8.16,-0.47,-10.58555060982505
O=C1NC(=O)c2c1c(-c1ccncc1)cc1[nH]c3ccc(O)cc3c21,CHEMBL378347_active,WEE1,Active,1.0,-9.05828,-12.26,1.02,-22.55517884298144
CCc1ccc([C@@H]2C(C#N)=C(N)N(c3ccccc3[N+](=O)[O-])C3=C2C(=O)CCC3)s1,C04143471_decoy,WEE1,Decoy,0.0,-6.50217,-5.28,-0.98,-4.556990637865728
COc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)ccc1OCc1ccccc1,C02502482_decoy,WEE1,Decoy,0.0,-8.38813,-9.92,-0.14,-11.539584758068916
CCc1nn(-c2ccc(F)cc2)c(O)c1/C=C1\NC(=O)N(Cc2ccc(C)cc2)C1=O,C04354633_decoy,WEE1,Decoy,0.0,-7.14735,-9.76,-3.46,-9.6688681326092
COc1ccc(OCc2ccc([C@H]3C(C#N)=C(N)OC4=C3C(=O)CC(C)(C)C4)o2)cc1,C01003180_decoy,WEE1,Decoy,0.0,-9.40525,-10.24,-4.73,-8.915822827063995
O=C(NCc1ccco1)c1ccc(NC(=O)N2C[C@H]3CCCN3c3ccccc32)cc1,C06751746_decoy,WEE1,Decoy,0.0,-6.58418,-7.64,-2.32,-6.267886491423407
O=C(Nc1cccc2ccccc12)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2NC(=O)c1ccccc1,C04235385_decoy,WEE1,Decoy,0.0,-6.298,-7.55,-2.62,-5.449960645900169
O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1nc(-c2ccc3c(c2)CCCC3)cs1,C09056228_decoy,WEE1,Decoy,0.0,-8.8955,-9.86,-0.47,-7.690695957767048
O=C(Nc1nc2c(s1)CC[C@@H]2C(=O)NCC1CCCCC1)c1ccc2c(c1)OCO2,C09300964_decoy,WEE1,Decoy,0.0,-8.72505,-9.66,-1.27,-12.59588819079537
COc1ccc(/C=N/N=C2\N=C(O)C[C@H](C(=O)Nc3cc(Cl)ccc3C)S2)cc1,C09317617_decoy,WEE1,Decoy,0.0,-9.43531,-8.76,-0.45,-7.143308393434475
O=C(Nc1nc2c(s1)CCCC2)c1cccc(C(=O)Nc2nc3c(s2)CCCC3)n1,C09367603_decoy,WEE1,Decoy,0.0,-9.73247,-11.15,-5.78,-12.982991940509317
C[C@@H]1Oc2c(C(=O)Nc3ccc(S(=O)(=O)Nc4nccs4)cc3)cccc2[C@@H]1C,C09367469_decoy,WEE1,Decoy,0.0,-8.41566,-9.29,-1.12,-7.933639699496097
O=C(COC(=O)C1c2ccccc2Oc2ccccc21)NC(=O)Nc1ccccc1F,C10797490_decoy,WEE1,Decoy,0.0,-7.31716,-8.43,-2.91,-6.903899589935844
COc1ccc(S(=O)(=O)c2nnn(-c3ccc(N)cc3)c2-c2ccc(F)cc2)cc1,C11730525_decoy,WEE1,Decoy,0.0,-8.26753,-5.4,-2.95,-5.057261982618278
CCNC(=O)NC(=O)[C@H](C)Sc1nc2sc(C)c(C)c2c(=O)n1C1CCCC1,C12821172_decoy,WEE1,Decoy,0.0,-8.42675,-7.32,-2.14,-7.554823048964597
O=C(Nc1nc2ccccc2[nH]1)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1,C06147668_decoy,WEE1,Decoy,0.0,-7.87958,-10.69,-3.09,-7.858718496012769
Cc1[nH]o/c(=N\S(=O)(=O)c2ccc(NC(=O)c3cc4c(s3)CCC4)cc2)c1C,C14169230_decoy,WEE1,Decoy,0.0,-8.42363,-9.62,-3.65,-11.001443942681174
O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2,C14472413_decoy,WEE1,Decoy,0.0,-8.20355,-7.23,-2.07,-5.7206329531631805
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCCCN3)cc2)c1,C16098442_decoy,WEE1,Decoy,0.0,-8.41915,-8.83,-2.58,-7.758692783027763
O=C(NNS(=O)(=O)c1ccc2c(c1)OCCO2)c1cc2c(s1)CCCCCC2,C16100718_decoy,WEE1,Decoy,0.0,-8.19795,-6.23,-4.55,-5.003290610759139
C/C(=N\NC(=O)c1csc2ccccc12)c1ccc(NC(=O)c2cc(C)on2)cc1,C17091424_decoy,WEE1,Decoy,0.0,-8.02327,-7.91,-2.92,-6.2876405027371725
CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccccc3C(F)(F)F)[C@H]2C1,C06195036_decoy,WEE1,Decoy,0.0,-7.82154,-5.26,-0.26,-4.941679726931382
COc1ccccc1N1CCN(C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)CC1,C21002258_decoy,WEE1,Decoy,0.0,-8.34461,-9.98,-3.47,-7.192425267481714
C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1=O,C22190668_decoy,WEE1,Decoy,0.0,-8.3427,-9.46,-3.26,-7.829272932782887
Cc1occc1-c1nnc(SCC(=O)N2c3ccccc3CCc3ccccc32)n1N,C25460073_decoy,WEE1,Decoy,0.0,-6.26457,-7.82,-3.5,-5.863388355911459
O=C(NNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccccc2s1)[C@@H]1COc2ccccc2O1,C25529585_decoy,WEE1,Decoy,0.0,-9.61209,-5.37,-2.96,-5.336197600240974
CCOC(=O)[C@@]1(C#N)[C@@H](c2ccccc2)C(C#N)=C(N)C(C#N)(C#N)[C@@H]1c1ccccc1,C27271289_decoy,WEE1,Decoy,0.0,-4.96248,-5.0,-2.44,-2.936045671626636
C[C@@H]1CN(c2ccc(C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cn2)C[C@@H](C)O1,C30017796_decoy,WEE1,Decoy,0.0,-9.06177,-9.34,-1.38,-8.152836723850255
N#Cc1cc2c(nc1N1CC[NH+]([C@H](C(=O)[O-])c3c[nH]c4cc(Cl)ccc34)CC1)CCCC2,C32101475_decoy,WEE1,Decoy,0.0,-8.01406,-7.84,-1.03,-6.465417951320974
Cc1ccc(NC(=O)c2nnc([C@@H]3CCCN(C(=O)NC4CCCCC4)C3)s2)cc1,C33113369_decoy,WEE1,Decoy,0.0,-9.10088,-8.42,-4.02,-8.641793054731892
C[C@@H]1CCCN(C2=NC(=O)/C(=C/c3ccc(-c4ccc(S(N)(=O)=O)cc4)o3)S2)C1,C34107785_decoy,WEE1,Decoy,0.0,-9.82859,-10.06,-0.07,-8.14426575081443
Cc1cc(C)c2[nH]c(C(=O)N3CCC(n4nccc4NC(=O)C4CC4)CC3)c(C)c2c1,C12314999_decoy,WEE1,Decoy,0.0,-8.0947,-9.18,-3.6,-7.391912479285613
N#CC1=C(N)Oc2cc(OC(=O)[C@H]3COc4ccccc4O3)ccc2[C@@H]1c1ccccc1F,C38687946_decoy,WEE1,Decoy,0.0,-9.43376,-10.24,-1.02,-8.21984619864009
CC(C)C1=C[C@@H]([C@H]2NN[C@H]3SC(COc4ccc(Br)cc4)=NN23)N=N1,C38742622_decoy,WEE1,Decoy,0.0,-9.32179,-8.12,-1.35,-7.739506597838963
C[C@H]1NN(c2ccccc2)[C@@H](C)[C@H]1/C=N/NC(=O)[C@@H]1C=C(c2ccc(Cl)cc2)N=N1,C39577343_decoy,WEE1,Decoy,0.0,-7.93855,-6.4,-2.19,-5.2056448517402565
C[C@H]1NN(c2ccccc2)[C@@H](C)[C@@H]1/C=N/NC(=O)[C@@H]1C=C(c2ccc(Cl)cc2)N=N1,C39577347_decoy,WEE1,Decoy,0.0,-8.11913,-6.85,-3.29,-5.1928538685516
O=C(Nc1nc2ccccc2s1)c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccco1)N2,C39980655_decoy,WEE1,Decoy,0.0,-8.28615,-5.7,-0.8,-5.757669089995667
COc1ccc(-c2csc(NC(=O)[C@H]3CCCN(C(=O)NC(C)C)C3)n2)cc1F,C40131161_decoy,WEE1,Decoy,0.0,-9.17541,-8.75,-2.87,-8.343206446826224
C[C@@]1(C(=O)Nc2nnc(Cc3cccs3)s2)Oc2ccc(Cl)cc2NC1=O,C41549380_decoy,WEE1,Decoy,0.0,-9.32684,-6.03,-0.43,-4.833704808931322
CC(C)(C)c1ccc(C(=O)NCC(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)cc1,C46659270_decoy,WEE1,Decoy,0.0,-8.69629,-8.67,-1.24,-7.403302429692458
CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(N4CCC(C)=N4)cc3)n2)cc1,C46761431_decoy,WEE1,Decoy,0.0,-9.27743,-7.43,-2.71,-6.284555186471799
Cc1ccc(NC(=O)Cn2c(=O)cnc3cc(C(=O)NC4CCCC4)ccc32)c(C)c1,C49008032_decoy,WEE1,Decoy,0.0,-7.84306,-9.15,-1.44,-8.11743404196157
O=C(Nc1nc(-c2ccco2)cs1)[C@H]1CCCN(C(=O)NCc2cccs2)C1,C49424960_decoy,WEE1,Decoy,0.0,-9.35238,-5.26,-2.33,-4.741592459618544
CN(C)c1ccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](c2ccco2)N3)cc1,C00919445_decoy,WEE1,Decoy,0.0,-6.32227,-9.11,-1.45,-9.999304782438983
COc1ccc(OC)c(NC(=O)C2=C(C)N(C)C(=S)N[C@@H]2c2cccc(C#N)c2)c1,C22827657_decoy,WEE1,Decoy,0.0,-7.24048,-6.78,-1.05,-6.270117503925859
C[S@](=O)(=NS(=O)(=O)NC(=O)Nc1cccc(C(F)(F)F)c1)c1ccccc1,C13466333_decoy,WEE1,Decoy,0.0,-8.03344,-8.57,-3.1,-7.588196583311957
COc1cc(Br)c([C@H]2C(C#N)=C(N)OC3=NN=C(c4ccccc4)[C@@H]32)cc1OC,C01110968_decoy,WEE1,Decoy,0.0,-4.89792,-4.96,0.06,-3.3244981777166074
CC(=O)c1ccc(NC(=O)[C@H]2CC(O)=Nc3c(C)c(-c4ccc(Cl)cc4)nn32)cc1,C32072164_decoy,WEE1,Decoy,0.0,-8.63142,-10.87,-2.06,-12.22518183387432
Cc1ccc(NC(=O)c2nnc([C@H]3CCCN3C(=O)Nc3ccc(C)cc3)s2)cc1,C64930587_decoy,WEE1,Decoy,0.0,-7.78837,-8.63,-3.82,-7.528233198594302
Cc1ccc(NC(=O)c2nnc([C@H]3CCCN3C(=O)Nc3cccc(C)c3)s2)cc1,C64930607_decoy,WEE1,Decoy,0.0,-8.62494,-9.1,-3.1,-8.909263920713066
CSc1ccc([C@@H]2NC(=O)N(CC(=O)Nc3ccc(Cl)cc3)C3=C2C(=O)OC3)cc1,C67288959_decoy,WEE1,Decoy,0.0,-10.1019,-5.92,-2.49,-6.212376673816496
COC(=O)c1c(NC(=O)c2cccnc2Cl)sc(C(=O)Nc2ccc(C)cc2C)c1C,C00685870_decoy,WEE1,Decoy,0.0,-9.26946,-8.16,-1.18,-8.403744392843176
O=C(NC(=S)Nc1ccccc1Br)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1,C09064654_decoy,WEE1,Decoy,0.0,-8.33887,-8.8,-1.56,-7.845760490972951
CCc1nnc2n1N[C@@H](c1ccc(OC)cc1)[C@H](C(=O)Nc1ccccc1C(F)(F)F)S2,C09239323_decoy,WEE1,Decoy,0.0,-8.55711,-8.93,-3.0,-8.25556755609961
CCc1nnc2n1N[C@H](c1ccc(OC)cc1)[C@@H](C(=O)Nc1ccccc1C(F)(F)F)S2,C09239324_decoy,WEE1,Decoy,0.0,-7.29588,-5.5,-2.45,-5.044466465730582
O=C(Nc1ccccc1)[C@@H]1Sc2nnc(COc3ccccc3)n2N[C@H]1c1ccc(F)cc1,C09295313_decoy,WEE1,Decoy,0.0,-9.00882,-8.35,-1.06,-8.352063591003956
O=C(Nc1ccc(Cl)cc1)Nc1nc(C(=O)N2CCN(c3ccccc3F)CC2)cs1,C08979937_decoy,WEE1,Decoy,0.0,-9.16028,-8.46,-2.47,-7.395261930488777
COCCn1/c(=N/C(=O)Cc2cccc3ccccc23)sc2cc(S(N)(=O)=O)ccc21,C09279777_decoy,WEE1,Decoy,0.0,-8.65907,-8.3,-1.07,-9.114359268981914
C[C@]1(c2cc3ccccc3o2)NC(=O)N(CC(=O)N[C@@H](c2ccccc2)c2cccs2)C1=O,C09789063_decoy,WEE1,Decoy,0.0,-9.8263,-9.92,-5.35,-11.143631457313589
C[C@]1(c2cc3ccccc3o2)NC(=O)N(CC(=O)N[C@H](c2ccccc2)c2cccs2)C1=O,C09789065_decoy,WEE1,Decoy,0.0,-9.4573,-9.87,-4.3,-10.568580726864257
Cc1ccc(OCc2nnc(SCc3cc4c(cc3Br)OCO4)n2N)c(C)c1,C09790932_decoy,WEE1,Decoy,0.0,-8.15005,-8.42,-2.4,-6.82350069665305
CCOC(=O)C1=C(N)OC2=C(C(=O)CC(C)(C)C2)[C@@]12C(=O)N(CCC(C)C)c1ccccc12,C09926763_decoy,WEE1,Decoy,0.0,-7.04893,-5.05,-0.87,-4.030271644091709
C/C(=N\NC(=O)CNc1ccc(I)c(C)c1)c1ccc([N+](=O)[O-])cc1,C12445859_decoy,WEE1,Decoy,0.0,-7.08324,-8.62,-3.12,-6.127942769403794
CCOC(=O)[C@@]1(C(N)=O)O[C@@]12CC[C@@H]1[C@H]3CC[C@@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@@H]3CC[C@@]12C,C12657694_decoy,WEE1,Decoy,0.0,-8.07038,-6.75,-1.79,-5.337423284533946
Cc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C,C02095752_decoy,WEE1,Decoy,0.0,-7.64522,-9.14,-2.83,-8.448191381569139
Cc1ccccc1-n1c(S[C@@H](C)C(=O)NC(=O)NC2CC2)nnc1-c1ccc(Cl)cc1,C10395566_decoy,WEE1,Decoy,0.0,-8.09627,-7.06,-1.55,-5.927683052385689
CC1=NC2=C(C(=O)C[C@H](c3ccco3)C2)[C@@H](c2ccc(O)cc2)C1C(=O)Nc1ccc(C)cn1,C06281018_decoy,WEE1,Decoy,0.0,-7.95413,-4.89,-2.36,-5.199481601148138
Cc1cc(-c2cc(C(=O)Nc3ccc(C(=O)NC4CC4)cc3)c3cnn(C(C)C)c3n2)c(C)s1,C14118978_decoy,WEE1,Decoy,0.0,-9.1138,-9.12,-1.64,-10.024735566039071
C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCCC2,C14283662_decoy,WEE1,Decoy,0.0,-7.2964,-10.04,-4.08,-9.663762412432114
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N[C@@H](C)c3ccc4c(c3)OCO4)cc2)cc1C,C14484610_decoy,WEE1,Decoy,0.0,-9.37382,-9.93,-3.87,-7.500516940704718
CCc1ccc(-c2csc(NC(=O)CN3C(=O)N[C@@](C)(c4ccc(F)cc4)C3=O)n2)cc1,C14857020_decoy,WEE1,Decoy,0.0,-8.59736,-8.26,-1.66,-9.659178141269829
CCNC(=O)NC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1-c1ccccc1F)CC[C@@H](C)C3,C09482072_decoy,WEE1,Decoy,0.0,-10.1534,-8.74,-2.02,-10.096769537254191
CNC(=O)NC(=O)CSc1nc2sc3c(c2c(=O)n1-c1ccc(C)c(Cl)c1)CCCC3,C09965920_decoy,WEE1,Decoy,0.0,-9.84697,-7.76,-2.96,-7.764580054856156
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(Cl)cc3)c2)cc1,C15511008_decoy,WEE1,Decoy,0.0,-8.48778,-9.77,-1.89,-9.24323042500251
Cc1ccc(N2C(=O)C[C@H](C(=O)OCc3nc(N)c4ccccc4n3)[C@@H]2c2cccs2)cc1,C18261732_decoy,WEE1,Decoy,0.0,-7.30892,-5.8,-3.59,-4.393514541486241
O=[N+]([O-])c1ccc([C@H]2Nc3ccc(S(=O)(=O)NCc4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1,C20756573_decoy,WEE1,Decoy,0.0,-8.85694,-8.38,-2.08,-7.4399107612453985
COc1ccc(-n2ccnc2S[C@H](C)C(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)cc1,C21492520_decoy,WEE1,Decoy,0.0,-9.29294,-8.62,-4.2,-10.48869277811497
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](C)CC3)cc1,C22131233_decoy,WEE1,Decoy,0.0,-9.61039,-10.04,-2.19,-8.826794114072964
COc1ccccc1NS(=O)(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](C)CC3)cc1,C22131234_decoy,WEE1,Decoy,0.0,-8.52592,-10.11,-3.76,-7.60470876551151
COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)NC(c1ccccc1)c1ccccc1,C22506148_decoy,WEE1,Decoy,0.0,-8.16825,-5.1,-2.39,-4.828650448778388
O=C(Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1)c1ccccc1,C22893335_decoy,WEE1,Decoy,0.0,-8.81142,-9.2,-2.78,-7.344616508194338
CCOC(=O)[C@@]1(C(N)=O)O[C@@]12CC[C@H]1[C@H]3CC[C@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@@]12C,C35361144_decoy,WEE1,Decoy,0.0,-8.10594,-4.62,-2.12,-4.72991276534781
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(-c3csc(N/N=C/c4cccc(O)c4)n3)c2)C1,C33960228_decoy,WEE1,Decoy,0.0,-11.4221,-9.51,-1.89,-9.891030725205432
COc1cc2c(cc1OC)[C@H](CNC(=O)C1CCCC1)N(C(=O)Nc1ccc(C)cc1)CC2,C35667285_decoy,WEE1,Decoy,0.0,-8.75067,-5.07,-1.67,-5.348333243379044
Cc1ccc(-c2nc(CC(=O)Nc3cccc(S(=O)(=O)/N=C4/CCCN4)c3)cs2)cc1,C36386968_decoy,WEE1,Decoy,0.0,-10.4111,-9.53,-2.86,-10.07406509317549
O=C(N[C@@H]1CCCN1C(=O)/C=C/c1ccccc1)N[C@@H]1CCCN1C(=O)/C=C/c1ccccc1,C16941194_decoy,WEE1,Decoy,0.0,-7.66406,-8.43,-3.93,-8.141961208269096
COc1ccc(CNC(=O)Nc2ccc3c(c2)N(S(=O)(=O)c2ccc(F)cc2)CCC3)cc1,C38693695_decoy,WEE1,Decoy,0.0,-9.7377,-7.24,-3.19,-6.788042704862017
C[C@@H]1Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3ccc(N4CCCCC4)cc3)cc2NC1=O,C39606947_decoy,WEE1,Decoy,0.0,-10.0324,-8.1,-2.53,-7.480393774673223
CC(C)[C@H](NC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)c1nc2ccccc2[nH]1,C40157373_decoy,WEE1,Decoy,0.0,-8.83127,-9.55,-4.31,-9.859007849041584
Cc1c(C(=O)Nc2nc3ccccc3s2)oc2c1/C(=N/NC(=O)c1ccccc1F)CCC2,C40812419_decoy,WEE1,Decoy,0.0,-9.33982,-10.23,-3.95,-7.876886267799347
COc1ccc(C(=O)Nc2ccc3ccccc3n2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C,C45579301_decoy,WEE1,Decoy,0.0,-9.39139,-10.03,-2.04,-16.80694126266082
COc1ccc(Cc2nnc(SCc3nc(N)c4c5c(sc4n3)C[C@@H](C)CC5)o2)cc1,C45599194_decoy,WEE1,Decoy,0.0,-11.2362,-8.88,-1.71,-8.62780392503566
Cc1cc(C)c(NC(=O)CNC(=O)c2cc(-c3ccco3)n(-c3ccc(Cl)cc3)n2)c(C)c1,C46566603_decoy,WEE1,Decoy,0.0,-8.60619,-8.8,-4.3,-7.364823970295294
C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)C1,C46716857_decoy,WEE1,Decoy,0.0,-8.43303,-10.26,-1.42,-10.577681372436462
Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cc(NC(=O)C4CC4)ccc3C)CC2)c(C)c1,C46793171_decoy,WEE1,Decoy,0.0,-9.24426,-9.1,-4.08,-8.015755320920338
C=CCN1C(=O)N[C@@H](c2ccc(F)cc2)C2=C1CN([C@@H](C)C(=O)Nc1ccc(F)cc1)C2=O,C50274040_decoy,WEE1,Decoy,0.0,-7.62851,-8.77,-1.63,-8.807199849558852
O=C(CSc1nnc(NC2CCCCC2)s1)Nc1cc2c(cc1Cl)OCCCO2,C11293270_decoy,WEE1,Decoy,0.0,-10.5958,-8.5,-4.03,-8.90009701349672
O=C(C[C@H]1C(=O)N(c2ccccc2)C(=S)N1NC(=O)c1ccccc1)Nc1ccc(F)cc1,C58940622_decoy,WEE1,Decoy,0.0,-7.51877,-9.79,-3.36,-8.263369448826165
COC(=O)[C@@H](NC(=O)N1CCc2nc[nH]c2[C@H]1c1ccc(F)c(Br)c1)C(C)C,C40288104_decoy,WEE1,Decoy,0.0,-8.96586,-9.15,-1.72,-12.117457955561232
COc1ccc(C(=O)Nc2nc(C)c(-c3csc(NC(=O)C4CCCCC4)n3)s2)cc1,C62049521_decoy,WEE1,Decoy,0.0,-9.98783,-9.07,-4.08,-7.788299043268945
COC(=O)C1=C(CN2CCN(c3ccc(Cl)cc3)CC2)NC(=O)N[C@@H]1c1ccc(F)cc1,C67204906_decoy,WEE1,Decoy,0.0,-9.01489,-5.52,-1.6,-5.422857119253602
O=C1C[C@H](c2ccc(Cl)cc2)[C@@H](n2cncn2)C(O)=C1[C@@H]1[NH2+]CCc2ccccc21,C04002382_decoy,WEE1,Decoy,0.0,-8.99758,-5.38,-1.82,-4.517401510158297
C[C@H]([NH2+][C@H](C)c1cccs1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1,C08185779_decoy,WEE1,Decoy,0.0,-9.37867,-8.07,-2.94,-8.085293981996582
C[C@H]([NH2+][C@H](C)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccs1,C08185783_decoy,WEE1,Decoy,0.0,-9.7201,-7.94,-1.97,-7.769858212200675
CN1CCCc2cc([C@H](CNC(=O)C(=O)Nc3ccccc3C(F)(F)F)[NH+](C)C)ccc21,C09135431_decoy,WEE1,Decoy,0.0,-8.23324,-9.39,-1.21,-9.054045765422854
CN1CCCc2cc([C@@H](CNC(=O)C(=O)Nc3ccc(F)c(F)c3)[NH+]3CCCC3)ccc21,C09135601_decoy,WEE1,Decoy,0.0,-8.47588,-10.13,-1.91,-8.772405323465879
C[C@@H](Cc1ccsc1)[NH2+]C1CCN(c2ccc(NC(=O)c3cnccn3)cc2)CC1,C12455938_decoy,WEE1,Decoy,0.0,-10.7574,-5.46,-0.72,-8.026978818180629
COc1cc(OC)c2[nH]c(C(=O)NC[C@@H](c3cccs3)[NH+]3CCC(C)CC3)cc2c1,C12923115_decoy,WEE1,Decoy,0.0,-9.61507,-9.01,-3.34,-8.69487039127953
CN1CCc2cc([C@@H](CNC(=O)C(=O)Nc3ccc(C(F)(F)F)cc3)[NH+]3CCCC3)ccc21,C08964117_decoy,WEE1,Decoy,0.0,-8.62008,-9.29,-3.6,-7.687362244954548
O=C(CCc1[nH]nc2c1CCCC2)N[C@@H]1CCCN(c2ccc(C(F)(F)F)c[nH+]2)C1,C12446477_decoy,WEE1,Decoy,0.0,-7.99443,-8.88,-2.65,-7.040824500902335
Cn1nc(C(=O)N2CCc3ccccc3C2)c2c1CC[C@H]([NH2+]CC1(O)CCCCC1)C2,C14740943_decoy,WEE1,Decoy,0.0,-9.05145,-6.95,-1.55,-7.584563052492453
Cn1nc(C(=O)N2CCc3ccccc3C2)c2c1CC[C@@H]([NH2+]CC1(O)CCCCC1)C2,C14740944_decoy,WEE1,Decoy,0.0,-9.22396,-9.1,-4.13,-8.15895412188849
OC[C@@H]1CCCN(c2nc3cc4c(cc3cc2C[NH2+]CCC2=CCCCC2)OCO4)C1,C14885806_decoy,WEE1,Decoy,0.0,-9.39185,-6.76,-3.02,-6.839149976708102
CC(=O)Nc1ccc(C[NH+]2CCc3c([nH]c4ccccc34)[C@H]2c2cnn(C(C)C)c2)s1,C20776552_decoy,WEE1,Decoy,0.0,-9.58619,-7.62,-3.46,-8.05111545417968
CCOC(=O)c1sc(N)c(C#N)c1C[NH+]1CCN(Cc2ccc(Cl)s2)CC1,C23334555_decoy,WEE1,Decoy,0.0,-9.71174,-7.56,-1.32,-10.382988523648836
CC(=O)c1cc2c(cc1NC(=O)C[NH2+][C@@H](c1ccc(F)cc1)c1cccs1)OCO2,C24838125_decoy,WEE1,Decoy,0.0,-8.89909,-9.15,-4.8,-9.684294783785708
CC(C)(CNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)[NH+]1CCc2ccccc2C1,C25897831_decoy,WEE1,Decoy,0.0,-7.4611,-8.28,-3.66,-6.275936548842864
Cc1ccc(NC(=O)NC(=O)[C@H](C)[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)c(C)c1,C29235924_decoy,WEE1,Decoy,0.0,-8.14026,-7.91,-4.58,-4.922241403319499
CSc1ccc([C@@H](C)NC(=O)c2ccc(S(=O)(=O)Nc3cc[nH+]cc3)cc2)cc1,C31688432_decoy,WEE1,Decoy,0.0,-8.70318,-8.81,-2.03,-8.009297532667796
CC(C)NC(=O)C[NH+]1CCC(NC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)CC1,C32934750_decoy,WEE1,Decoy,0.0,-9.89837,-7.69,-2.38,-7.400946401952165
Cc1cc[nH+]c(N[C@@H](c2ccccn2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)c1,C38547398_decoy,WEE1,Decoy,0.0,-9.15067,-5.33,-3.59,-5.641958986181724
CCOC(=O)c1c(NC(=O)c2sc(C)nc2C)sc2c1CC(C)(C)[NH2+]C2(C)C,C38806360_decoy,WEE1,Decoy,0.0,-9.3257,-8.06,-1.9,-8.910029352362157
Clc1ccc(C2=NN=C[C@H]2CN2CC[C@@H]3NN[C@@H](Cc4ccccc4)[NH+]3CC2)cc1,C39485917_decoy,WEE1,Decoy,0.0,-9.74825,-9.95,-1.61,-9.10423989202769
Clc1ccc(C2=NN=C[C@H]2CN2CC[C@@H]3NN[C@H](Cc4ccccc4)[NH+]3CC2)cc1,C39485918_decoy,WEE1,Decoy,0.0,-8.4856,-9.11,-2.57,-9.055778592935289
Clc1ccc(C2=NN=C[C@H]2CN2CC[C@H]3NN[C@H](Cc4ccccc4)[NH+]3CC2)cc1,C39485920_decoy,WEE1,Decoy,0.0,-8.26779,-8.45,-1.87,-7.562296370850847
O=S(=O)(Oc1ccccc1)c1cc(F)ccc1N1CC[NH2+][C@@H](c2ccccc2O)C1,C39530506_decoy,WEE1,Decoy,0.0,-7.65253,-8.43,-3.67,-6.53288475781951
Cc1cccc(C(=O)N2C[C@@H](C(=O)N[C@@H]3CCC[C@H]3OCc3ccccc3)C3(CC[NH2+]CC3)C2)c1,C39608863_decoy,WEE1,Decoy,0.0,-8.2524,-8.4,-3.59,-6.198965446778408
CC(C)CNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39624659_decoy,WEE1,Decoy,0.0,-9.32417,-6.07,-3.19,-5.921544589397072
CCOc1cccc(C(=O)N2C[C@H](C(=O)N[C@H]3CCC[C@H](C)[C@@H]3C)C3(CC[NH2+]CC3)C2)c1,C39637507_decoy,WEE1,Decoy,0.0,-8.24259,-6.4,-2.43,-6.3035657366486015
COc1cccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)c1,C39676808_decoy,WEE1,Decoy,0.0,-7.44661,-6.03,-3.97,-5.931446308601685
COc1ccccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C)c(C)c2)CC12CC[NH2+]CC2,C39686648_decoy,WEE1,Decoy,0.0,-9.01296,-7.58,-2.05,-7.086610390836662
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(C)c(C)c2)CC12CC[NH2+]CC2,C39686649_decoy,WEE1,Decoy,0.0,-7.52963,-5.67,-2.92,-5.239563467073512
C=C(C)CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39691004_decoy,WEE1,Decoy,0.0,-7.59157,-6.4,-1.67,-4.699526974461104
CCc1ccc([C@H](C)NC(=O)[C@@H]2CN(C(=O)c3cccc(N(C)C)c3)CC23CC[NH2+]CC3)cc1,C39696127_decoy,WEE1,Decoy,0.0,-8.53385,-7.07,-2.72,-6.295261376903044
O=C(Nc1cccc(Cl)c1)NN1C(=O)/C(=C\C2=c3ccccc3=[NH+]C2)SC1=S,C39934663_decoy,WEE1,Decoy,0.0,-7.22589,-8.49,-2.68,-6.1704738247650495
CCNC(=O)[C@@H]1C2=C(CCCC2)S[C@H]1NC(=O)/C(C#N)=C/C1=c2ccccc2=[NH+]C1,C39992136_decoy,WEE1,Decoy,0.0,-9.13878,-7.45,-1.87,-8.144529658084862
Cc1ccc(C)c(NC(=O)C[NH+]2CCC[C@@H](C(=O)Nc3ccc(Br)cn3)C2)c1,C40149602_decoy,WEE1,Decoy,0.0,-8.77235,-8.04,-2.8,-7.117173942908477
C[C@@H]1CN(c2ccc(NC(=O)NC[C@@H](c3cccs3)[NH+](C)C)cc2F)C[C@@H](C)O1,C57853786_decoy,WEE1,Decoy,0.0,-8.23365,-9.49,-1.03,-14.279293741168887
Nn1c(S[C@@H]2C(=O)[NH+]=c3ccccc3=C2c2ccccc2)nnc1-c1ccccc1F,C39769015_decoy,WEE1,Decoy,0.0,-8.78387,-9.57,-1.67,-8.327779299318335
COc1ccc2c(c1)=C(CCNC(=O)CS[C@H]1CCc3ccccc3N=C1O)C[NH+]=2,C63303182_decoy,WEE1,Decoy,0.0,-10.2213,-8.87,-2.97,-8.645080170442771
COc1ccc([C@@H]2N/C(=C\C(=O)NCCC3=c4ccccc4=[NH+]C3)CS2)cc1OC,C63491110_decoy,WEE1,Decoy,0.0,-9.9931,-8.73,-2.86,-9.161158638613744
O=C(NC[C@@H]1C=c2ccccc2=[NH+]1)C1=CNN2C(C(F)(F)F)=CC(c3cccs3)=N[C@H]12,C63538106_decoy,WEE1,Decoy,0.0,-8.41866,-9.42,-1.25,-8.499797644290792
CC1=NN([C@H]2Nc3ccccc3S2)C(=O)/C1=C(/C)NCCC1=c2ccccc2=[NH+][C@@H]1C,C63097159_decoy,WEE1,Decoy,0.0,-9.24791,-5.94,-1.91,-5.831031955329837
COc1ccccc1CNC(=O)[C@H]1[NH+]=c2ccccc2=C1NC(=O)c1ccc(Cl)cc1,C63752613_decoy,WEE1,Decoy,0.0,-9.05683,-6.6,-2.21,-6.757709865409925
COc1ccc(CNC(=O)[C@H]2[NH+]=c3ccc(C)cc3=C2NC(=O)c2ccc(F)cc2)cc1,C63752745_decoy,WEE1,Decoy,0.0,-8.46392,-6.53,-2.89,-6.068805802152664
CC(C)[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1nc(C2=c3ccccc3=[NH+]C2)cs1,C63806853_decoy,WEE1,Decoy,0.0,-9.68062,-9.41,-3.6,-8.562117515944019
Cc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)N[C@H]3Nc4c(C)cccc4S3)CC1=O)C[NH+]=2,C63941262_decoy,WEE1,Decoy,0.0,-9.03892,-9.16,-1.89,-7.080126657123373
CC(=O)c1ccc(NC(=O)[C@@H](CC2=c3ccccc3=[NH+]C2)NC(=O)c2cccs2)cc1,C64735021_decoy,WEE1,Decoy,0.0,-8.85986,-9.78,-4.69,-9.96995621155333
Cc1c(C(=O)NC2CC[NH+](C)CC2)sc2nc(-c3ccccc3)c(NC(C)(C)C)n12,C64761316_decoy,WEE1,Decoy,0.0,-9.93927,-8.28,-0.57,-13.018346431174573
Cc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccccc2C)cc1,C65074669_decoy,WEE1,Decoy,0.0,-8.55564,-4.97,-3.64,-6.049587771489663
Cc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2cccc(F)c2)cc1,C65074676_decoy,WEE1,Decoy,0.0,-8.69955,-8.0,-2.93,-8.365044476348446
NC(=O)[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1,C08708095_decoy,WEE1,Decoy,0.0,-6.99308,-8.04,-1.3,-7.851626748729275
Cc1cc(C)c(NC(=O)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)[NH+]2CCc3ccccc3C2)c(C)c1,C10129856_decoy,WEE1,Decoy,0.0,-7.19562,-8.55,-2.9,-5.864538344284673
C[C@@H](NC(=O)c1ccc(N2CCC([NH2+]Cc3ccc4c(c3)OCO4)CC2)cc1)c1ccccc1,C12181439_decoy,WEE1,Decoy,0.0,-9.11999,-6.31,-3.05,-5.171069183774956
C[NH2+][C@H]1CCc2cc(OC)c(OC)c(OC)c2-c2ccc(NCc3ccc(F)cc3)c(=O)cc21,C12658186_decoy,WEE1,Decoy,0.0,-9.59562,-6.01,-1.84,-5.468699612054197
CC1(C)CC(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3)C2)CC(C)(C)[NH2+]1,C14350945_decoy,WEE1,Decoy,0.0,-8.50524,-8.82,-1.95,-7.217801526956267
Cc1c(C(=O)NCC2([NH+]3CCCCC3)CCCCC2)sc2ncnc(N[C@@H]3CCOC3)c12,C15070972_decoy,WEE1,Decoy,0.0,-9.87448,-8.32,-0.81,-8.579131451608502
COC(=O)c1c(NC(=O)C[NH+]2CCC(C(=O)Nc3ccccc3)CC2)sc2c1CCCC2,C15550730_decoy,WEE1,Decoy,0.0,-9.17389,-8.59,-3.68,-7.238238973086036
COc1ccc(NC(=O)c2c(NC(=O)C[NH+]3CCCC[C@@H]3C)sc3c2CCC3)c(OC)c1,C15946648_decoy,WEE1,Decoy,0.0,-9.15347,-8.45,-1.88,-13.377988304479471
C[C@H](C(=O)N1CCCC1)[C@H]1CC[C@@]2(C)Cc3s/c(=N\C(=O)C[NH+](C)C)[nH]c3[C@@H](C)[C@@H]2[C@H]1O,C20504582_decoy,WEE1,Decoy,0.0,-7.63637,-5.14,-1.52,-5.083096203971939
O=C(Nc1ccccc1NC(=O)c1ccc(Cl)cc1)OCC1CCN(c2cc[nH+]cc2)CC1,C28525746_decoy,WEE1,Decoy,0.0,-9.91163,-9.06,-1.83,-9.035406283659752
O=C(c1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)ccc1N1CC[NH2+]CC1)N1CCCCCC1,C33121115_decoy,WEE1,Decoy,0.0,-9.26982,-6.83,-1.7,-6.828317125710174
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccc(NC(=O)C3CCC3)c2)N2CCCSC2=[NH+]1,C33713307_decoy,WEE1,Decoy,0.0,-8.91898,-5.81,-1.7,-5.016336912447081
Cc1cccc(NC(=O)Nc2ccc(N3CCCN(C(=O)c4cc(F)cc(F)c4)CC3)[nH+]c2)c1,C34681190_decoy,WEE1,Decoy,0.0,-8.17762,-5.47,-3.27,-4.7213384486411885
Cc1ccccc1C(=O)N1CCCN(c2ccc(NC(=O)Nc3ccc(F)cc3F)c[nH+]2)CC1,C34681347_decoy,WEE1,Decoy,0.0,-7.9458,-10.63,-3.3,-11.8912653428103
CNC(=O)C1=C(C)[NH+]=C2SCCCN2[C@@H]1c1cccc(NS(=O)(=O)c2ccc(C)cc2)c1,C35337840_decoy,WEE1,Decoy,0.0,-10.1184,-10.28,-3.57,-9.7812214921717
COC(=O)c1cccc(NC(=O)N2CCc3[nH]c[nH+]c3[C@@H]2c2ccc(Br)cc2)c1,C20746115_decoy,WEE1,Decoy,0.0,-9.69613,-5.47,-2.54,-6.508940797596195
COC(=O)[C@@H](CCSC)NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(Br)cc1,C36601955_decoy,WEE1,Decoy,0.0,-10.9905,-6.73,-2.48,-8.234359964764256
CCc1cc([C@H](Nc2cccc(C)[nH+]2)c2ccc3c(c2)OCO3)c(NC(=O)c2ccco2)s1,C38547922_decoy,WEE1,Decoy,0.0,-10.3251,-8.16,-4.3,-10.082231596478072
Brc1cccc(CS[C@H]2NN[C@H]3N(/N=C/C4=c5ccccc5=[NH+]C4)C=NN23)c1,C39188347_decoy,WEE1,Decoy,0.0,-8.49583,-9.61,-3.18,-9.238097561994609
Cc1ccc(CC(=O)N2C[C@@H](C(=O)N[C@@H]3CCC[C@H]3OCc3ccccc3)C3(CC[NH2+]CC3)C2)cc1,C39609129_decoy,WEE1,Decoy,0.0,-8.39587,-8.64,-3.74,-9.405648814051656
Cc1ccccc1CC(=O)N1C[C@@H](C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)C2(CC[NH2+]CC2)C1,C39609131_decoy,WEE1,Decoy,0.0,-9.15734,-7.31,-1.76,-7.68883399772317
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)NC2CCCCCC2)C2(CC[NH2+]CC2)C1,C39633784_decoy,WEE1,Decoy,0.0,-8.68297,-5.58,-3.22,-6.272211685479175
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)N[C@H]2CCCC[C@@H]2C)C2(CC[NH2+]CC2)C1,C39636127_decoy,WEE1,Decoy,0.0,-8.91805,-5.71,-4.43,-6.005763001112945
COc1ccc(C(=O)N2C[C@H](C(=O)NC3CCCCCCC3)C3(CC[NH2+]CC3)C2)c(OC)c1,C39659773_decoy,WEE1,Decoy,0.0,-8.29248,-6.41,-1.78,-4.820458177006644
Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)Cc3cccc(C)c3)CC23CC[NH2+]CC3)cc1,C39666295_decoy,WEE1,Decoy,0.0,-8.31103,-9.03,-1.74,-7.794377744283962
CC[C@@H](C(=O)N1C[C@H](C(=O)N[C@H](C)c2cccc(OC)c2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39676749_decoy,WEE1,Decoy,0.0,-9.30777,-6.84,-3.17,-6.0809253912444285
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CC12CC[NH2+]CC2,C39686367_decoy,WEE1,Decoy,0.0,-8.7278,-7.96,-2.49,-8.403843262034043
CCc1ccc([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc1,C39695994_decoy,WEE1,Decoy,0.0,-8.82593,-8.11,-2.78,-7.0607432504347205
CCc1ccc([C@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc1,C39695995_decoy,WEE1,Decoy,0.0,-9.52408,-9.19,-3.93,-9.9145654880569
CCc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc1,C39695997_decoy,WEE1,Decoy,0.0,-8.6927,-6.37,-2.83,-6.07514992669968
CCc1ccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(-c4ccccc4)o3)CC23CC[NH2+]CC3)cc1,C39696264_decoy,WEE1,Decoy,0.0,-9.41634,-9.42,-3.69,-7.656068356701494
Cc1ccccc1NC(=O)Nc1ccc(N2CCCN(C(=O)c3ccc(Cl)cc3)CC2)[nH+]c1,C40415836_decoy,WEE1,Decoy,0.0,-8.54981,-6.03,-4.2,-5.024154355960188
O=C(NC1CC[NH+](Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)CC1)c1ccc2[nH]ccc2c1,C40961041_decoy,WEE1,Decoy,0.0,-8.44781,-9.88,-3.8,-9.049939649944935
CC(=O)Nc1ccc(NC(=O)[C@H]2CCC[NH+](Cc3nc(-c4ccc(C(C)(C)C)cc4)no3)C2)cc1,C44813699_decoy,WEE1,Decoy,0.0,-9.20203,-9.15,-2.38,-7.859730253380111
COc1ccc(N2CCN(Cc3nc(N)nc(N(c4ccccc4)c4ccccc4)[nH+]3)CC2)cc1,C20018828_decoy,WEE1,Decoy,0.0,-8.04762,-9.07,-2.84,-9.975425513602692
C[C@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cc(F)ccc1N1CC[NH+](C)CC1,C58161400_decoy,WEE1,Decoy,0.0,-7.48201,-8.47,-3.86,-8.059573813250795
C[C@@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1cc(F)ccc1N1CC[NH+](C)CC1,C58161401_decoy,WEE1,Decoy,0.0,-7.78087,-9.62,-1.79,-6.366426051700528
CC(/C=C/c1ccc(N(C)C)cc1)=N/[NH+]=C(/N)S[C@H]1CC(=O)N(c2cccc(Cl)c2)C1=O,C33630212_decoy,WEE1,Decoy,0.0,-9.09777,-7.97,-2.16,-7.538529157745591
CC[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2ccc(OC(=O)c4ccc(Cl)cc4)cc2)N3)C1,C15947257_decoy,WEE1,Decoy,0.0,-8.72082,-9.79,-1.26,-7.701165348482992
Nn1c(Cc2ccccc2F)nnc1S[C@H](C(=O)C1=c2ccccc2=[NH+]C1)c1ccccc1,C39945664_decoy,WEE1,Decoy,0.0,-9.36759,-9.15,-2.55,-8.17816001190352
COC(=O)c1ccccc1NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(Br)cc1,C20720968_decoy,WEE1,Decoy,0.0,-8.32232,-5.16,-2.83,-5.9558864374901095
CC(C)C[C@H](NC(=O)[C@@H]1CC2=c3ccccc3=[NH+][C@H]2[C@@H]2c3ccccc3C(=O)N12)C(=O)NC1CCCCC1,C63383509_decoy,WEE1,Decoy,0.0,-10.0446,-6.86,-1.62,-7.612794654321705
CCC(C)(C)[C@H]1NN=C(NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(Cl)ccc4=[NH+]C3)C2)S1,C63557160_decoy,WEE1,Decoy,0.0,-9.54192,-7.95,-1.26,-7.303169232299854
COc1ccc(CNC(=O)[C@H]2[NH+]=c3ccc(C)cc3=C2NC(=O)c2cccc(C)c2)cc1OC,C63752908_decoy,WEE1,Decoy,0.0,-7.8354,-9.69,-5.04,-8.258254468196977
O=C(CN1C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C1=O)Nc1ccc(Cl)c(C(F)(F)F)c1,C63869538_decoy,WEE1,Decoy,0.0,-8.257,-9.48,-2.59,-8.311977383945145
O=C(CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)Nc1ccc(N2CCCC2)cc1,C40072858_decoy,WEE1,Decoy,0.0,-10.9776,-8.77,-1.08,-11.301272301060235
COc1ccc(C(=O)N[C@H](C(=O)Nc2nc(C3=c4ccccc4=[NH+][C@H]3C)cs2)C(C)C)cc1,C64338127_decoy,WEE1,Decoy,0.0,-8.89251,-8.12,-1.44,-7.704183758367902
CCCc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2cccc(F)c2)cc1,C65074634_decoy,WEE1,Decoy,0.0,-9.64172,-8.72,-3.0,-8.73050407869005
Cc1cc(C)c(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccc(F)c(Cl)c2)c(C)c1,C65074652_decoy,WEE1,Decoy,0.0,-8.44153,-8.83,-3.31,-7.74142568022032
COC(=O)[C@H](CCSC)NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(Br)cc1,C20728439_decoy,WEE1,Decoy,0.0,-10.3303,-4.35,-1.17,-5.183679893126511
CCOC(=O)c1c(NC(=O)Nc2ccc(C)cc2)sc2c1CC[NH+](CC)C2,C07987370_decoy,WEE1,Decoy,0.0,-7.58314,-8.73,-1.46,-11.310543917154073
NC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]2[C@H]2c3ccccc3C=C[NH+]12,C09281119_decoy,WEE1,Decoy,0.0,-7.7079,-4.73,-1.77,-4.621215612293667
Cc1ccc2c(C)c(C(=O)N3CCC(C(N)=O)([NH+]4CCCCC4)CC3)oc2c1C,C12314710_decoy,WEE1,Decoy,0.0,-7.77939,-5.69,-2.15,-5.16039049568375
COc1ccc2c(c1)OC1(CC[NH+](C[C@@H](O)c3ccc4c(c3)CCO4)CC1)C[C@H]2O,C12329302_decoy,WEE1,Decoy,0.0,-9.51841,-9.82,-1.52,-8.718404046120712
COC(=O)[C@@H]1C[C@@H](NC(=O)Nc2ccccc2)C[NH+]1CC1=CC[C@H]2C[C@@H]1C2(C)C,C12451383_decoy,WEE1,Decoy,0.0,-8.56686,-9.37,-2.3,-9.04537430797075
COc1ccc([C@@H]2[C@@H]3CCCC[C@@]3(O)CC[NH+]2CC(=O)NCc2ccco2)cc1,C02154884_decoy,WEE1,Decoy,0.0,-9.40059,-8.4,-2.12,-10.11752691135759
O[C@@H](C[NH+]1CCC2(CC1)C[C@H](O)c1cc(Cl)ccc1O2)c1ccc2c(c1)OCCO2,C19345581_decoy,WEE1,Decoy,0.0,-8.92339,-9.49,-3.12,-6.620316227782501
Cc1cc(N2CC[NH+](C)CC2)nc2ccc(NC(=S)NC[C@@H]3CCCO3)cc12,C20153726_decoy,WEE1,Decoy,0.0,-8.87509,-9.11,-3.91,-7.8299441771122975
CCOC(=O)C1=C(C[NH+]2C[C@@H](C)C[C@H](C)C2)NC(=O)N[C@@H]1c1ccc(F)cc1,C20214251_decoy,WEE1,Decoy,0.0,-8.40824,-5.48,-1.11,-4.735804481266349
Cc1cc(C)n(-c2ccc(N3CCC([NH2+]Cc4cc(C5CC5)[nH]n4)CC3)cc2)n1,C23191775_decoy,WEE1,Decoy,0.0,-8.76134,-7.69,-2.13,-6.5526610500100135
CC[C@@H]1c2ccsc2CC[NH+]1CC(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C,C30223874_decoy,WEE1,Decoy,0.0,-8.11282,-8.26,-1.66,-7.96436533940002
CCOC(=O)C1CC[NH+](Cc2c(-c3ccc(F)cc3)nc3ccc(N)cn23)CC1,C36270867_decoy,WEE1,Decoy,0.0,-7.8193,-8.01,-1.07,-9.265888073608131
COc1cccc(C(=O)N2C[C@@H](C(=O)N[C@H]3CCC[C@H](C)[C@H]3C)C3(CC[NH2+]CC3)C2)c1,C39637142_decoy,WEE1,Decoy,0.0,-7.92255,-5.7,-2.02,-5.53746921251939
COc1cccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3ccc(C)cc3)C3(CC[NH2+]CC3)C2)c1,C39639234_decoy,WEE1,Decoy,0.0,-5.98958,-7.97,-1.7,-5.891125552541335
O=C(NC1CCCCCCC1)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2,C39659958_decoy,WEE1,Decoy,0.0,-8.43824,-6.02,-1.81,-4.502579130473154
CC1(C(=O)N2C[C@@H](C(=O)NCCc3ccco3)C3(CC[NH2+]CC3)C2)CCCCC1,C39670959_decoy,WEE1,Decoy,0.0,-8.1051,-5.38,-1.41,-5.981351357190632
O=C(NN1C(=O)/C(=C/C2=c3ccccc3=[NH+]C2)SC1=S)c1ccccc1O,C39923351_decoy,WEE1,Decoy,0.0,-10.7865,-7.86,-1.12,-10.527910640920206
C[NH+](C)C(C)(C)c1ccn2c(-c3ccnc(N)n3)c(-c3ccc(F)cc3)nc2c1,C40425347_decoy,WEE1,Decoy,0.0,-7.62789,-9.67,-0.07,-8.151637302862797
CC(C)NC(=O)N1CCC(C(=O)NC[C@H](c2cccs2)[NH+]2CCCC2)CC1,C46810199_decoy,WEE1,Decoy,0.0,-9.08563,-7.11,-1.5,-7.431271350087329
C[NH+](C)C1(CNC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)CCCCC1,C47746511_decoy,WEE1,Decoy,0.0,-7.42142,-7.37,-1.6,-5.426054974085538
CC(C)(C)c1nnc(NC(=O)NC[C@H]2CCC[NH+](Cc3cccs3)C2)s1,C50058366_decoy,WEE1,Decoy,0.0,-9.96477,-7.82,-1.04,-7.81775583910883
O=C(NC[C@@H]1CCC[NH+](Cc2cccs2)C1)Nc1nnc(C(F)F)s1,C50059520_decoy,WEE1,Decoy,0.0,-8.64582,-7.12,-1.71,-9.43266234715403
COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)[NH+]1CCC[C@H](C(=O)NC2CC2)C1,C51046363_decoy,WEE1,Decoy,0.0,-8.31095,-7.17,-3.97,-4.40190419236929
C[C@@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)C(=O)Nc2nc3ccccc3s2)C1,C54940246_decoy,WEE1,Decoy,0.0,-8.02953,-7.53,-1.84,-6.209100647155255
C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)C(=O)Nc2nc3ccccc3s2)C1,C54940248_decoy,WEE1,Decoy,0.0,-7.30797,-9.38,-3.53,-6.650583816387695
Cc1cc(N(C)C)ccc1NC(=O)C(=O)NCC(C)(C)[NH+]1C[C@H](C)C[C@@H](C)C1,C54946451_decoy,WEE1,Decoy,0.0,-8.67574,-8.43,-1.63,-8.587809525924362
C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)Nc2ccccc2CC(=O)N(C)C)C1,C56744312_decoy,WEE1,Decoy,0.0,-8.49091,-8.26,-2.7,-7.683131586158537
C[C@@H](Cc1ccccc1F)NC(=O)Nc1ccc(C(=O)N2CC[NH+](C)CC2)cc1,C56753544_decoy,WEE1,Decoy,0.0,-7.22342,-8.55,-1.27,-10.996779178742814
[NH3+]C1CCN(Cc2nnn(-c3ccc(Cl)c(C(F)(F)F)c3)c2-c2ccncc2)CC1,C57345561_decoy,WEE1,Decoy,0.0,-8.45039,-10.02,-0.58,-10.8959085559559
CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCC(C)CC2)[nH+]c1,C61900158_decoy,WEE1,Decoy,0.0,-7.89923,-8.1,-2.68,-6.814791149085488
C[NH+]1CCN(c2ccc(NC(=O)CNC(=O)[C@H]3C[C@H]3c3ccccc3)cc2)CC1,C62214258_decoy,WEE1,Decoy,0.0,-8.71076,-8.77,-0.3,-14.806692164072116
C[C@@H]1CCC[NH+]([C@H](C)CNC(=O)N2CCC[C@H](C(=O)NC3CCCCC3)C2)C1,C62485817_decoy,WEE1,Decoy,0.0,-9.35151,-4.89,-3.43,-4.405026084894621
Cc1ccc(N2C(=O)[C@@H]([C@H]3NCCC4=c5ccccc5=[NH+][C@@H]43)C(=O)N[C@H]2S)c(C)c1,C63720215_decoy,WEE1,Decoy,0.0,-8.14052,-5.8,-1.57,-3.900249168632703
Cc1cc(C(=O)N2CC=C(C3=c4ccccc4=[NH+]C3)CC2)cc(S(N)(=O)=O)c1C,C64182193_decoy,WEE1,Decoy,0.0,-8.06567,-5.89,-2.99,-4.561915072955628
CC(C)C1=CC(=O)N2[C@@H](CC(=O)NCCC3=c4ccccc4=[NH+]C3)CS[C@H]2N1,C64652829_decoy,WEE1,Decoy,0.0,-8.61064,-8.85,-2.41,-8.671622420870412
O=S(=O)(c1ccccc1)N1CCC2(CC1)NCC[NH+]=C2NCc1ccccc1F,C65074691_decoy,WEE1,Decoy,0.0,-8.14571,-6.07,-3.01,-4.6728779565297724
CC(C)(C)NC1=[NH+]CCNC12CCN(S(=O)(=O)c1ccc(Cl)cc1)CC2,C65074704_decoy,WEE1,Decoy,0.0,-7.97635,-5.71,-2.7,-4.349534989471015
Cc1ccccc1C(=O)N1CC[C@@]2(C1)Nc1cccnc1N/C2=[NH+]\C1CCCC1,C65266349_decoy,WEE1,Decoy,0.0,-7.79293,-5.65,-2.86,-4.862415861717735
CC(C)[NH+]1CC[C@@H](CNC(=O)NCc2ccc(-c3nc4ccccc4s3)o2)C1,C65441300_decoy,WEE1,Decoy,0.0,-8.57161,-8.43,-1.78,-7.85395555749465
Cc1cc(NC(=O)C(=O)N[C@H]2CC[NH+]([C@@H](C)c3ccccc3)C2)ccc1N(C)C,C65571880_decoy,WEE1,Decoy,0.0,-7.45552,-9.13,-0.55,-9.845920482671362
COc1cc(Br)cc(C)c1NC(=O)NC[C@H](c1ccco1)[NH+](C)C,C65752271_decoy,WEE1,Decoy,0.0,-7.41921,-6.36,-2.03,-8.547613452980192
O=C(NC1CC1)C1CCN(C(=O)NC2CC[NH+](CC3CCCCC3)CC2)CC1,C66037983_decoy,WEE1,Decoy,0.0,-8.61713,-5.81,-2.73,-5.442297106378167
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H]([NH+]3CCCC3)C2)c1,C66160344_decoy,WEE1,Decoy,0.0,-8.80501,-8.66,-1.82,-8.166662118069615
CCC[C@@H](NC(=O)NC1CC[NH+](CC)CC1)C(=O)N1CCc2sccc2C1,C66175197_decoy,WEE1,Decoy,0.0,-7.44226,-5.96,-3.02,-5.048287658051512
CCC[C@H](NC(=O)N[C@H]1CCC[NH+](CC)C1)C(=O)N1CCc2sccc2C1,C66187597_decoy,WEE1,Decoy,0.0,-8.43612,-8.16,-2.88,-5.04745082711962
CCC[C@@H](NC(=O)N[C@@H]1CC[NH+](C(C)C)C1)C(=O)N1CCc2sccc2C1,C66190216_decoy,WEE1,Decoy,0.0,-8.49,-6.83,-1.22,-8.569888490905027
Cc1ccc([C@H](NC(=O)NCc2cccnc2N2CC[NH+](C)CC2)C2CC2)cc1,C66986245_decoy,WEE1,Decoy,0.0,-7.89181,-9.07,-2.09,-7.721990920413503
Cc1ccc(F)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CC[NH+](C)CC2)cc1,C67426688_decoy,WEE1,Decoy,0.0,-8.38317,-8.82,-1.43,-8.781667767272513
Cc1ccc(C)c(NC(=O)C(=O)N[C@H](C)c2ccc(N3CC[NH+](C)CC3)cc2)c1,C67426712_decoy,WEE1,Decoy,0.0,-8.41796,-7.81,-1.85,-7.091242050935864
CC(C)C(=O)NC1CCN(C(=O)NC[C@H]2CCC[NH+]2CC2CCCCC2)CC1,C67481832_decoy,WEE1,Decoy,0.0,-9.26076,-7.33,-4.31,-5.9008146940645725
CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2ccc(C)cc2[nH+]c1N1CCCCC1,C06545751_decoy,WEE1,Decoy,0.0,-6.79457,-4.24,-0.23,-3.7203295401906353
O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)C1CCN(C(=O)Nc2ccccc2)CC1,C08132888_decoy,WEE1,Decoy,0.0,-8.38824,-6.04,-2.24,-6.1854009682822575
O=C(C[NH+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NC(=O)NCCC1=CCCCC1,C08310536_decoy,WEE1,Decoy,0.0,-9.14385,-8.73,-4.05,-8.901268849938287
CCOC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc2c1CC(C)(C)[NH2+]C2(C)C,C09174708_decoy,WEE1,Decoy,0.0,-9.41413,-9.94,-2.04,-9.624008851647607
COC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)[C@@H](C)[NH+]1CCCC(C)(C)C1,C02309842_decoy,WEE1,Decoy,0.0,-8.06043,-7.59,-1.39,-8.085538092434259
Cc1nn(-c2ccccc2[N+](=O)[O-])c(C)c1[C@@H]1C=C[C@@H]([NH2+]Cc2c[nH]c3ccccc23)C1,C15673896_decoy,WEE1,Decoy,0.0,-7.15235,-8.97,-2.65,-7.16046934159534
COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)[NH+]2CCc3ccccc3C2)cc1,C16443065_decoy,WEE1,Decoy,0.0,-8.31198,-8.62,-3.59,-6.650806184055461
CC(C)[C@@H]1[NH2+][C@]2(C(=O)Nc3ccccc32)[C@@H]2C(=O)N(c3ccc(Br)cc3)C(=O)[C@H]21,C09331020_decoy,WEE1,Decoy,0.0,-8.61132,-5.23,-1.52,-5.246877955304034
CCOC(=O)c1c(NC(=O)c2cc3cccc(OC)c3oc2=[NH2+])sc2c1CC[C@@H](C)C2,C19631814_decoy,WEE1,Decoy,0.0,-9.42636,-9.53,-1.89,-8.02420956784282
O=C(C[NH+]1CC[C@]2(O)CCCC[C@@H]2[C@H]1c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1,C20375527_decoy,WEE1,Decoy,0.0,-7.28806,-7.3,-3.65,-6.61060134670293
COc1ccc(NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C2CC[NH2+]CC2)c(OC)c1,C20940940_decoy,WEE1,Decoy,0.0,-8.41757,-4.68,-2.73,-4.817598419202215
CC(=O)[NH+]=c1ccc2c(CSc3nc(-c4ccc(Cl)cc4)n[nH]3)cc(O)oc-2c1,C21253811_decoy,WEE1,Decoy,0.0,-11.5236,-6.22,-0.86,-6.34304057764148
C[C@H](C(=O)Nc1ccc2c(c1)OC(F)(F)O2)[NH+]1CCC(NC(=O)c2ccccc2)CC1,C28109017_decoy,WEE1,Decoy,0.0,-8.10521,-10.14,-3.12,-9.587892083299629
C[C@@H](C(=O)Nc1ccc2c(c1)OC(F)(F)O2)[NH+]1CCC(NC(=O)c2ccccc2)CC1,C28109023_decoy,WEE1,Decoy,0.0,-7.44829,-7.24,-2.06,-6.602457558563942
O=C(Nc1ccccc1)Nc1ccc(N2CCCN(C(=O)c3ccc(F)cc3)CC2)[nH+]c1,C34681165_decoy,WEE1,Decoy,0.0,-8.70898,-9.74,-2.47,-7.0359844273570085
Cc1cccc(NC(=O)Nc2ccc(N3CCCN(C(=O)c4ccccc4)CC3)[nH+]c2)c1,C34681179_decoy,WEE1,Decoy,0.0,-8.25438,-6.06,-3.63,-4.960568454316259
CC(C)(C)NC(=O)Nc1ccc(N2CCCN(C(=O)c3ccc(Cl)cc3)CC2)[nH+]c1,C34681327_decoy,WEE1,Decoy,0.0,-8.20667,-5.11,-2.27,-5.806178412714545
Cc1ccc(-n2cc(-c3ccc(Cl)cc3)[nH]/c2=N\C(=O)C[NH2+]C[C@H]2CCCO2)cc1,C36039468_decoy,WEE1,Decoy,0.0,-8.76769,-8.97,-1.86,-7.773951182657227
CC[C@@H](C)[C@H](NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(F)c(F)c1F)C(=O)OC,C20744650_decoy,WEE1,Decoy,0.0,-8.48153,-4.62,-3.83,-5.368195953800247
CC(=O)/[NH+]=c1/ccc2c(CSc3nnc(NC4CCCCC4)s3)cc(O)oc-2c1,C36799233_decoy,WEE1,Decoy,0.0,-8.7136,-9.79,-4.07,-9.08585250625612
CCOC(=O)c1c(NC(=O)c2cc(C)nn2C(C)C)sc2c1CC(C)(C)[NH2+]C2(C)C,C38507000_decoy,WEE1,Decoy,0.0,-8.68985,-5.46,-1.6,-5.524385421546662
O=C(NC[C@H](c1ccco1)[NH+]1CCN(c2ccc(F)cc2)CC1)Nc1ccccc1F,C38598010_decoy,WEE1,Decoy,0.0,-7.51475,-6.18,-2.24,-4.746775134210216
COC(=O)c1c(NC(=O)c2ccc(Br)o2)sc2c1CC(C)(C)[NH2+]C2(C)C,C38806162_decoy,WEE1,Decoy,0.0,-9.00816,-4.63,-0.55,-4.764894389127226
CCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@H]([NH2+]C1[C@@H]3CC4C[C@H]1CC(O)(C4)C3)C2,C14731576_decoy,WEE1,Decoy,0.0,-9.99571,-5.68,-1.65,-5.964267979740882
Cc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@H](C)Oc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)cc1C,C39596277_decoy,WEE1,Decoy,0.0,-7.9434,-6.69,-1.33,-6.230981751219745
CCCCNC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39624113_decoy,WEE1,Decoy,0.0,-7.91214,-8.59,-3.96,-8.475211923218975
C[C@@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)NC2CCCCCC2)C2(CC[NH2+]CC2)C1,C39633510_decoy,WEE1,Decoy,0.0,-8.63796,-6.9,-1.52,-6.982424703197226
N#C[C@H](NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccccc3F)o2)CC12CC[NH2+]CC2)c1ccccc1,C39662565_decoy,WEE1,Decoy,0.0,-9.40301,-7.96,-4.3,-6.300790420069983
Cc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3cc(C)nn3C(C)(C)C)CC23CC[NH2+]CC3)c(C)c1,C39667125_decoy,WEE1,Decoy,0.0,-8.28611,-8.92,-2.11,-8.384537218896007
C[C@H](NC(=O)[C@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2)C(C)(C)C,C39684593_decoy,WEE1,Decoy,0.0,-9.15827,-5.32,-3.72,-6.612192378951632
O=C1[NH+]=c2ccccc2=C2NC(Nc3nc4ccccc4o3)=N[C@@H](c3ccc(F)cc3)[C@@H]12,C39916370_decoy,WEE1,Decoy,0.0,-6.91767,-11.26,-1.97,-7.315233579572748
CC(C)[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N/N=C/C1=c2ccccc2=[NH+]C1,C39937985_decoy,WEE1,Decoy,0.0,-9.5301,-9.15,-3.09,-8.480668686485487
O=C(C[NH+]1CCC(Nc2ncnc3scc(-c4ccc(F)cc4)c23)CC1)NC1CC1,C40122897_decoy,WEE1,Decoy,0.0,-8.98527,-8.4,-0.35,-17.1668728355501
Nc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(C4CC[NH+](CC5CC5)CC4)ccn23)n1,C40428682_decoy,WEE1,Decoy,0.0,-8.90322,-7.92,-0.24,-8.964085433775308
COc1cc(OC)c2[nH]c(C(=O)Nc3nc(C[NH+]4C[C@H](C)C[C@H](C)C4)cs3)cc2c1,C45898325_decoy,WEE1,Decoy,0.0,-8.28636,-7.85,-1.87,-7.0576476790854485
COC(=O)C1=C(CN2CC[NH+](C3CCCCC3)CC2)NC(=O)N[C@@H]1c1ccc(C)cc1,C51318354_decoy,WEE1,Decoy,0.0,-8.42386,-7.66,-3.1,-7.189499458873423
CC1CC[NH+]([C@H](CNC(=O)Nc2cnc3c(cnn3C(C)C)c2)c2cccs2)CC1,C58079580_decoy,WEE1,Decoy,0.0,-9.7065,-8.47,-3.09,-8.581763268590041
CC[NH+]1CCC2=c3ccccc3=[NH+][C@H]2[C@@H]1c1c([O-])[nH]c(=O)n(-c2cc(C)cc(C)c2)c1=O,C63384076_decoy,WEE1,Decoy,0.0,-6.81196,-10.7,-2.1,-7.149382403820462
CC[NH+]1CCC2=c3ccccc3=[NH+][C@H]2[C@@H]1c1c([O-])[nH]c(=O)n(-c2ccc(C)cc2C)c1=O,C63384224_decoy,WEE1,Decoy,0.0,-6.49565,-10.71,-3.88,-7.567462079057526
O=C(NNC(=O)[C@@H]1C=c2cc(OC(F)(F)F)ccc2=[NH+]1)c1cccc(C(F)(F)F)c1,C63598856_decoy,WEE1,Decoy,0.0,-6.2331,-9.73,-1.81,-7.132042802811157
CC1=NN([C@H]2Nc3ccccc3S2)C(=O)/C1=C(/C)NCCC1=c2ccccc2=[NH+][C@H]1C,C63097162_decoy,WEE1,Decoy,0.0,-9.50545,-5.77,-2.7,-6.137877046113481
C[C@H]1c2c(NCCC3=c4ccccc4=[NH+]C3)ncnc2S[C@H]1C(=O)N[C@@H]1CCOC(C)(C)C1,C64002344_decoy,WEE1,Decoy,0.0,-10.3918,-9.69,-1.23,-10.638888591307902
O=C(CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)Nc1ccc(-c2ccccc2)cc1,C64055351_decoy,WEE1,Decoy,0.0,-9.61177,-9.58,-1.46,-8.36620246898944
COc1ccc2c(c1)=C(CCNC(=O)C[C@@H]1C(=O)Oc3cc(C)cc(O)c3[C@H]1C)C[NH+]=2,C64417224_decoy,WEE1,Decoy,0.0,-9.51858,-10.67,-3.82,-11.006823875671456
O=C(CC1=c2ccccc2=[NH+]C1)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1,C64672726_decoy,WEE1,Decoy,0.0,-8.51171,-8.95,-1.28,-11.878873436183596
CCN1CC(C(=O)Nc2nc(C3=c4ccccc4=[NH+]C3)cs2)=C([O-])c2ccc(C)[nH+]c21,C64672744_decoy,WEE1,Decoy,0.0,-9.46439,-10.47,-1.31,-8.493248937793267
Cc1cc(C)c(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NC2CCCCC2)c(C)c1,C65074659_decoy,WEE1,Decoy,0.0,-8.01054,-6.49,-3.92,-4.464444593705607
CC(C)(C)c1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccccc2F)cc1,C65074726_decoy,WEE1,Decoy,0.0,-9.14623,-6.18,-2.51,-5.231100395348071
CCc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NC2CCCCCC2)cc1,C65074876_decoy,WEE1,Decoy,0.0,-7.90344,-5.12,-3.14,-5.131816000532234
COC(=O)c1ccccc1NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(F)c(F)c1F,C20723365_decoy,WEE1,Decoy,0.0,-8.84443,-5.45,-1.74,-5.647547328843093
CCOC(=O)c1c(NC(C)=O)sc2c(OC[C@H](O)C[NH2+]C3CCCCC3)c(Br)ccc12,C00823396_decoy,WEE1,Decoy,0.0,-10.0178,-7.8,-1.09,-10.059877495681548
COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc(N3CC[NH+](Cc4ccccc4F)CC3)cc2)c1,C08898029_decoy,WEE1,Decoy,0.0,-10.9259,-8.6,-3.06,-8.376174404787816
CC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(CC(C)C)CC(C)C)cc3)c2C(=O)NC)C1,C08920490_decoy,WEE1,Decoy,0.0,-11.2634,-9.52,-3.84,-11.360005133012551
CCN(CC)c1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2sc(C)c(C)c2C(=O)OC)cc1,C09158554_decoy,WEE1,Decoy,0.0,-11.0942,-9.52,-3.08,-9.668693116191648
CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CC[NH+](C)CC1,C09886393_decoy,WEE1,Decoy,0.0,-8.14224,-8.67,-3.84,-7.93116937299075
Cc1ccc(NC(=O)c2c(NC(=O)C[NH2+]Cc3cccnc3)sc3c2CC[C@H](C(C)(C)C)C3)c(C)c1,C00729089_decoy,WEE1,Decoy,0.0,-8.94495,-9.17,-4.79,-9.334846225006949
CC(C)c1ccc(C[NH2+][C@H]2C[C@@H](C(=O)NCCc3ccc4c(c3)OCO4)N(Cc3cccc(Cl)c3)C2)cc1,C20452125_decoy,WEE1,Decoy,0.0,-9.93544,-9.78,-3.85,-10.49740183833052
CC1(C)CC(NC(=O)CSc2n[nH]c(N/N=C/c3cccc(Oc4ccccc4)c3)n2)CC(C)(C)[NH2+]1,C20832050_decoy,WEE1,Decoy,0.0,-9.43239,-8.38,-2.27,-7.8018786555394035
CCCCN(CC)C(=O)c1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)ccc1N1CC[NH2+]CC1,C21664304_decoy,WEE1,Decoy,0.0,-9.01822,-7.71,-2.97,-7.883966659736412
Cc1ccc(NC(=O)c2c(NC(=O)C[NH+]3CCN(CCO)CC3)sc3c2CC[C@H](C(C)(C)C)C3)c(C)c1,C22635331_decoy,WEE1,Decoy,0.0,-10.709,-5.46,-3.25,-6.400721602773933
O=C(C[NH+]1CCC(NC(=O)Nc2ccccc2)CC1)N[C@@H]1CCc2cc(F)ccc2[C@@H]1Cc1cccnc1,C29388898_decoy,WEE1,Decoy,0.0,-8.68347,-7.21,-2.75,-6.214925513223661
CC(C)CN(CC(C)C)C(=O)c1ccc(N2CC[NH2+]CC2)c(NS(=O)(=O)c2ccc(C(C)C)cc2)c1,C33033385_decoy,WEE1,Decoy,0.0,-8.3887,-9.4,-2.71,-8.609411058291192
Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)NC3CCCCCC3)cnc2N2CC[NH2+]CC2)cc1C,C33129155_decoy,WEE1,Decoy,0.0,-10.2445,-9.94,-3.85,-9.16990038641774
CC1(C)Cc2c(sc3nc(SCC(N)=O)nc(N4CC[NH+](CC(=O)NC5CCCCC5)CC4)c23)CO1,C34750169_decoy,WEE1,Decoy,0.0,-12.2684,-8.25,-0.83,-15.462875735790588
COc1ccc(-c2nn(-c3ccc(C(F)(F)F)cc3)c(N)c2NC(=O)N2CC[NH+](C3CCCC3)CC2)cc1,C34786045_decoy,WEE1,Decoy,0.0,-8.03611,-6.24,-3.12,-6.301795564324936
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(CC)C(=O)N[C@H]1c1ccc(C)cc1C,C35646853_decoy,WEE1,Decoy,0.0,-7.75191,-4.05,-3.97,-5.133294104691628
C=CCN1C(=O)N[C@@H](c2ccc(F)cc2)C(C(=O)OCC)=C1C[NH+]1CCCN(C(=O)NC(C)C)CC1,C35664797_decoy,WEE1,Decoy,0.0,-7.96668,-5.27,-1.57,-6.7704313238014135
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(CC)C(=O)N[C@H]1c1ccc(Cl)cc1,C36014002_decoy,WEE1,Decoy,0.0,-7.82711,-4.94,-3.31,-6.241489101155329
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(CC)C(=O)N[C@H]1c1ccccc1OC,C36017188_decoy,WEE1,Decoy,0.0,-8.01489,-7.16,-2.83,-7.01282902703549
C=CCN1C(=O)N[C@H](c2ccc(Cl)cc2)C(C(=O)OCC)=C1C[NH+]1CCCN(C(=O)NC(C)(C)C)CC1,C36019094_decoy,WEE1,Decoy,0.0,-9.582,-6.39,-3.71,-7.50549218084569
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CC(C)(C)[NH2+]C3(C)C)cc1,C04177780_decoy,WEE1,Decoy,0.0,-10.09,-8.45,-1.14,-13.91039126373549
O=C(CS[C@H]1NN[C@H](c2cccc([N+](=O)[O-])c2)N1c1ccccc1)N/N=C/C1=c2ccccc2=[NH+]C1,C38959984_decoy,WEE1,Decoy,0.0,-9.77251,-9.94,-4.1,-11.406472442647868
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CS[C@H]1N=N/C(=[NH+]/N=C/c2ccc(Cl)cc2)N1,C39404340_decoy,WEE1,Decoy,0.0,-9.95209,-8.44,-1.89,-9.38619130721646
CCOC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CS[C@H]1N=N/C(=[NH+]/N=C/c2ccc(Cl)cc2)N1,C39404341_decoy,WEE1,Decoy,0.0,-10.2648,-9.32,-5.21,-9.43112129940238
Cc1ccc(N2C(SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)=NN[C@@H]2c2ccc(Cl)cc2)cc1,C39575890_decoy,WEE1,Decoy,0.0,-7.62003,-8.93,-4.27,-6.882348054964619
COc1ccc([C@H]2NN[C@@H](SCC(=O)N/N=C/C3=c4ccccc4=[NH+]C3)N2c2ccc(OC)cc2)cc1,C39575922_decoy,WEE1,Decoy,0.0,-10.0815,-9.38,-4.53,-9.07926978712038
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NCc2ccccc2Sc2ccccc2CO)C2(CC[NH2+]CC2)C1,C39657691_decoy,WEE1,Decoy,0.0,-9.77083,-10.34,-3.62,-10.54343850341937
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCc2ccccc2Sc2ccccc2CO)C2(CC[NH2+]CC2)C1,C39657758_decoy,WEE1,Decoy,0.0,-9.30548,-9.04,-2.68,-6.2420469947692645
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCCSCc2ccccc2)C2(CC[NH2+]CC2)C1,C39658711_decoy,WEE1,Decoy,0.0,-11.182,-9.91,-2.78,-7.110511543362192
COc1ccc(O[C@H](C)CNC(=O)[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)o3)CC23CC[NH2+]CC3)cc1,C39665817_decoy,WEE1,Decoy,0.0,-7.87943,-8.98,-1.65,-7.230531683659949
COc1ccc(O[C@H](C)CNC(=O)[C@H]2CN(C(=O)[C@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)cc1,C39665829_decoy,WEE1,Decoy,0.0,-9.70545,-8.72,-2.95,-9.325422978246928
Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3)CC23CC[NH2+]CC3)cc1,C39666000_decoy,WEE1,Decoy,0.0,-9.73012,-6.04,-3.08,-6.050240862072636
Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)[C@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)cc1,C39666263_decoy,WEE1,Decoy,0.0,-9.5961,-7.82,-2.65,-8.530571911527264
COc1ccc(CC[C@H](C)NC(=O)[C@H]2CN(C(=O)[C@@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)cc1,C39675470_decoy,WEE1,Decoy,0.0,-8.51952,-10.26,-3.96,-9.185563298627615
CCC[C@@H](C)C(=O)N1C[C@H](C(=O)NC(c2ccc(OC)cc2)c2ccc(OC)cc2)C2(CC[NH2+]CC2)C1,C39676552_decoy,WEE1,Decoy,0.0,-7.5616,-7.8,-3.31,-6.698846135489208
CC[C@@H](C(=O)N1C[C@H](C(=O)NCc2ccc(-c3ccccn3)s2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39677691_decoy,WEE1,Decoy,0.0,-8.92134,-9.36,-2.34,-7.302588984531975
CC[C@H](C(=O)N1C[C@H](C(=O)NCc2ccccc2N2CCCCC2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39678322_decoy,WEE1,Decoy,0.0,-9.64661,-10.03,-3.92,-9.79750025910418
COc1ccccc1C[C@H](C)NC(=O)[C@@H]1CN(C(=O)[C@@H](Oc2ccccc2)C(C)C)CC12CC[NH2+]CC2,C39686728_decoy,WEE1,Decoy,0.0,-8.79242,-10.37,-3.07,-9.155999826366203
C[C@@H](Cc1ccc(F)cc1)NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39688736_decoy,WEE1,Decoy,0.0,-10.1365,-8.83,-1.85,-8.27832564023348
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)C3CC[NH+](Cc4ccc(F)cc4)CC3)cc2)c(OC)c1,C39753498_decoy,WEE1,Decoy,0.0,-9.14207,-9.14,-2.04,-7.420658368858222
CC[NH2+]C1(C(N)=O)CCN(c2cnc(-c3ccc(C(F)(F)F)cc3)c(-c3ccnc(Cl)c3)n2)CC1,C40973220_decoy,WEE1,Decoy,0.0,-9.67491,-7.61,-0.67,-7.727136810186958
COc1cccc(C2(CNC(=O)Nc3c(C(C)C)cc(N)cc3C(C)C)CCN(c3cc[nH+]cc3)CC2)c1,C45302310_decoy,WEE1,Decoy,0.0,-8.5148,-5.42,-3.93,-5.638643519921468
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)[C@H](Oc4ccccc4)C(C)C)CC34CC[NH2+]CC4)[nH]c2c1,C39695847_decoy,WEE1,Decoy,0.0,-9.01755,-9.5,-3.53,-9.178697678526186
CCOC(=O)c1c(NC(=O)CSC2=[NH+]C3(CCCCC3)NN2c2ccccc2)sc2c1CCCC2,C59564783_decoy,WEE1,Decoy,0.0,-10.5105,-7.89,-3.02,-9.096941908650978
CCOC(=O)N1CCC2=C(C(=O)Nc3ccccc3OCC)[C@H](NCC3=c4ccccc4=[NH+]C3)S[C@@H]2C1,C63072167_decoy,WEE1,Decoy,0.0,-8.42166,-6.62,-3.69,-7.362701045636421
Cc1cccc(N2C(C3=c4ccccc4=[NH+]C3)=NN[C@@H]2S[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1,C39933351_decoy,WEE1,Decoy,0.0,-8.47232,-9.12,-4.1,-6.938987354275963
O=C(COC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1ccc(Cl)cc1)Nc1ccc2c(c1)OCO2,C63258817_decoy,WEE1,Decoy,0.0,-9.22163,-8.72,-2.22,-8.554237307603811
COc1ccc(C(=O)N/C(=C\c2cccc([N+](=O)[O-])c2)C(=O)NCCC2=c3ccccc3=[NH+][C@@H]2C)cc1,C63513883_decoy,WEE1,Decoy,0.0,-8.13342,-10.4,-4.23,-8.699931073828472
C[C@@H]1[NH+]=c2ccccc2=C1CCNC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1cccc([N+](=O)[O-])c1,C63514848_decoy,WEE1,Decoy,0.0,-8.25989,-10.33,-4.74,-8.539705471028318
COc1ccc2c(c1)=C(CCNC(=O)C1=CNN(C(C)(C)C)[C@@H]1C1CCN(C(=O)OC(C)(C)C)CC1)C[NH+]=2,C63584604_decoy,WEE1,Decoy,0.0,-7.32706,-9.01,-3.2,-6.261502697075686
CC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4CCCC[C@@H]4C)cc3)c2C(=O)NC)C1,C08920348_decoy,WEE1,Decoy,0.0,-11.3346,-7.49,-1.37,-8.145098985046674
COC(=O)c1c(NC(=O)CCCS(=O)(=O)c2ccc(OC)cc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C09911744_decoy,WEE1,Decoy,0.0,-9.74835,-8.73,-3.34,-8.191371468475388
COc1ccc(C2=NN(C(=O)C[NH2+]CCO)[C@@H](c3cn(-c4ccccc4)nc3-c3ccc(C)cc3)C2)cc1,C10435196_decoy,WEE1,Decoy,0.0,-8.29416,-8.68,-3.86,-8.005398674613367
CCC[NH+]1CCc2c(sc(NC(=O)[C@H]3CCCN(S(=O)(=O)c4ccc(C)cc4)C3)c2C(N)=O)C1,C14023394_decoy,WEE1,Decoy,0.0,-11.3162,-9.52,-1.0,-10.02584234148486
CCN(CC)C(=O)CSc1nc(N2CC[NH+](CC(N)=O)CC2)c2c3c(sc2n1)COC(C)(C)C3,C34750191_decoy,WEE1,Decoy,0.0,-10.4092,-7.5,-1.08,-9.21657623207644
C[C@@H]1CN(c2cc(Cl)nc(SCC(=O)N3CCCC[C@H]([NH3+])C3=O)n2)CCN1C(=O)CC(C)(C)C,C35294154_decoy,WEE1,Decoy,0.0,-9.93987,-8.33,-2.59,-8.137332859413895
O=C(C[C@@H]1C(=O)NCCN1C(=O)CN1CCN(c2cccc[nH+]2)CC1)Nc1cccc(C(F)(F)F)c1,C19818672_decoy,WEE1,Decoy,0.0,-7.03932,-9.58,-3.76,-7.60656190298403
COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)[C@@H]1CCC[NH+](Cc2nc(-c3ccccc3)no2)C1,C38885673_decoy,WEE1,Decoy,0.0,-9.98158,-9.1,-2.21,-8.13356663269224
COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)[C@H]1CCC[NH+](Cc2nc(-c3ccccc3)no2)C1,C38885675_decoy,WEE1,Decoy,0.0,-9.89988,-9.32,-3.17,-8.378043326908566
CC(C)S(=O)(=O)NC[C@@H](c1ccc(S(=O)(=O)C(C)C)cc1)N1CC[NH2+][C@H](Cc2ccccc2)C1,C39534434_decoy,WEE1,Decoy,0.0,-10.2761,-6.74,-4.19,-7.1151233702837855
CCSc1ncccc1C(=O)N1C[C@H](C(=O)NC[C@H](C)Oc2ccc(F)cc2)C2(CC[NH2+]CC2)C1,C39596177_decoy,WEE1,Decoy,0.0,-10.8272,-6.78,-2.55,-9.438259234007406
CC(=O)Oc1ccccc1C(=O)N1C[C@@H](C(=O)NCc2ccc(OC(F)(F)F)cc2)C2(CC[NH2+]CC2)C1,C39599571_decoy,WEE1,Decoy,0.0,-8.25589,-6.04,-2.73,-5.0974204419540685
O=C(NCc1ccc(OC(F)(F)F)cc1)[C@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39599863_decoy,WEE1,Decoy,0.0,-9.02728,-10.62,-2.23,-12.191785199835676
O=C(N[C@@H]1CCC[C@H]1OCc1ccccc1)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2,C39609096_decoy,WEE1,Decoy,0.0,-9.54618,-5.79,-2.27,-5.713798652591355
COc1cc(C(=O)N2C[C@@H](C(=O)NCCc3ccc(C)c(C)c3)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39609236_decoy,WEE1,Decoy,0.0,-9.46465,-7.55,-2.47,-8.10404196548306
C[C@@H](CCCC(C)(C)O)NC(=O)[C@H]1CN(C(=O)c2cccnc2Oc2ccccc2)CC12CC[NH2+]CC2,C39631834_decoy,WEE1,Decoy,0.0,-9.59485,-10.18,-1.9,-10.060891181584893
COc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)cc1OC,C39634496_decoy,WEE1,Decoy,0.0,-8.11308,-9.84,-3.6,-10.559870390623937
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)NCCc2ccccc2F)C2(CC[NH2+]CC2)C1,C39638958_decoy,WEE1,Decoy,0.0,-9.43421,-5.34,-3.18,-5.535901376535975
COc1cc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc(OC)c1,C39653038_decoy,WEE1,Decoy,0.0,-9.21411,-8.44,-3.55,-8.626686486555982
COc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3ccc(Br)cc3)C3(CC[NH2+]CC3)C2)cc1OC,C39656844_decoy,WEE1,Decoy,0.0,-9.97958,-8.34,-1.34,-9.33431907978484
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H](C#N)c3ccccc3)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C39662479_decoy,WEE1,Decoy,0.0,-9.41066,-9.3,-3.03,-9.249832059961204
COc1ccc(C(=O)N2C[C@@H](C(=O)N[C@H](C#N)c3ccccc3)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C39662481_decoy,WEE1,Decoy,0.0,-8.32549,-10.17,-1.68,-9.448561575414733
Cc1onc(-c2ccccc2)c1C(=O)N1C[C@@H](C(=O)NC[C@H](C)Oc2ccccc2)C2(CC[NH2+]CC2)C1,C39665419_decoy,WEE1,Decoy,0.0,-9.43402,-10.68,-2.95,-11.87764446567466
COc1ccc(O[C@H](C)CNC(=O)[C@@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc1,C39665628_decoy,WEE1,Decoy,0.0,-8.76669,-7.98,-2.17,-2.659538926181113
COc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)c3cc(C)oc3C(F)(F)F)CC23CC[NH2+]CC3)cc1,C39665799_decoy,WEE1,Decoy,0.0,-9.29369,-8.85,-2.28,-10.557735295682727
CCC(CC)CNC(=O)[C@@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CC12CC[NH2+]CC2,C39666869_decoy,WEE1,Decoy,0.0,-9.10095,-8.58,-3.4,-8.126769406211604
O=C(NC[C@H]1OCCc2ccccc21)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39668956_decoy,WEE1,Decoy,0.0,-8.44138,-6.71,-3.02,-5.975212167185932
O=C(NC[C@@H]1OCCc2ccccc21)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39668957_decoy,WEE1,Decoy,0.0,-8.16191,-9.06,-2.04,-8.745912916409688
O=C(NC[C@H]1OCCc2ccccc21)[C@H]1CN(C(=O)c2cccnc2Oc2ccccc2)CC12CC[NH2+]CC2,C39669128_decoy,WEE1,Decoy,0.0,-9.15377,-10.22,-2.22,-9.370426258791069
COc1ccc2nc(CCNC(=O)[C@@H]3CN(C(=O)c4ccc(C(F)(F)F)cc4)CC34CC[NH2+]CC4)[nH]c2c1,C39669848_decoy,WEE1,Decoy,0.0,-9.22569,-8.93,-2.69,-7.824515268478718
O=C(NCc1cc2ccccc2[nH]1)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39671432_decoy,WEE1,Decoy,0.0,-7.03803,-7.2,-3.46,-6.026641524404153
Cc1cc(C(=O)N2C[C@H](C(=O)NCc3ccc(OC(F)F)cc3)C3(CC[NH2+]CC3)C2)c(C(F)(F)F)o1,C39673384_decoy,WEE1,Decoy,0.0,-7.57991,-7.19,-3.78,-6.309755390530119
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc1,C39675251_decoy,WEE1,Decoy,0.0,-9.22033,-9.4,-2.05,-9.169164898337264
COc1ccc(CC[C@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(OC)cc3OC)CC23CC[NH2+]CC3)cc1,C39675252_decoy,WEE1,Decoy,0.0,-8.80257,-8.59,-3.28,-8.445682539897925
CCn1nc(C)c(Br)c1C(=O)N1C[C@@H](C(=O)N[C@H](C)c2cccc(OC)c2)C2(CC[NH2+]CC2)C1,C39676783_decoy,WEE1,Decoy,0.0,-8.40124,-7.73,-3.65,-7.566294857834748
COc1cc(C(=O)N2C[C@H](C(=O)NCCc3cc(C)ccc3C)C3(CC[NH2+]CC3)C2)cc(OC)c1OC,C39676951_decoy,WEE1,Decoy,0.0,-7.95605,-8.97,-2.62,-7.94907522690833
CC(=O)Oc1cccc(C(=O)N2C[C@@H](C(=O)NCc3ccccc3N3CCCCC3)C3(CC[NH2+]CC3)C2)c1C,C39678317_decoy,WEE1,Decoy,0.0,-9.77387,-8.59,-2.33,-9.769939873336224
COc1ccc(OC)c(CNC(=O)[C@H]2CN(C(=O)c3ccc(F)c(C(F)(F)F)c3)CC23CC[NH2+]CC3)c1,C39682972_decoy,WEE1,Decoy,0.0,-9.37351,-10.16,-0.66,-10.070943684583344
CC(C)[C@H](NC(=O)[C@H]1CN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC12CC[NH2+]CC2)C(=O)NC(C)(C)C,C39685761_decoy,WEE1,Decoy,0.0,-8.48065,-9.58,-2.9,-10.931117330455136
COc1ccccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)c2c(-c3ccccc3)noc2C)CC12CC[NH2+]CC2,C39686734_decoy,WEE1,Decoy,0.0,-9.01075,-10.13,-1.71,-10.07435731597306
Cc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCCC2)C2(CC[NH2+]CC2)C1,C39687237_decoy,WEE1,Decoy,0.0,-8.68902,-8.1,-3.48,-8.680672277502671
Cc1cc(C(=O)N2C[C@@H](C(=O)NCc3ccc(-n4cccc4)cc3)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39690270_decoy,WEE1,Decoy,0.0,-8.27285,-6.81,-2.75,-6.323165285957273
CC1(C(=O)N2C[C@@H](C(=O)NCCNC(=O)Cc3cccc4ccccc34)C3(CC[NH2+]CC3)C2)CCCCC1,C39691345_decoy,WEE1,Decoy,0.0,-8.71945,-9.6,-5.17,-7.397994479924646
O=C(Cc1cccc2ccccc12)NCCNC(=O)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39693324_decoy,WEE1,Decoy,0.0,-8.3926,-9.41,-4.01,-10.7498454206928
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCCNC(=O)OC(C)(C)C)C2(CC[NH2+]CC2)C1,C39693562_decoy,WEE1,Decoy,0.0,-8.38245,-7.47,-3.09,-7.322177960875597
CCc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)[C@@H]3CCCN3C(=O)C(F)(F)F)CC23CC[NH2+]CC3)cc1,C39695933_decoy,WEE1,Decoy,0.0,-8.20405,-7.7,-3.55,-8.40532695248322
CSc1ccc(C[NH+]2CCN(CC(=O)Nc3sc(C(N)=O)c(C)c3C(=O)OC(C)C)CC2)cc1,C39972170_decoy,WEE1,Decoy,0.0,-10.2687,-8.41,-2.2,-10.492482076936504
Cc1cc(C(=O)N2C[C@H](C(=O)NCCc3c(C)[nH]c4ccc(C#N)cc34)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C44714599_decoy,WEE1,Decoy,0.0,-9.00595,-8.72,-2.1,-8.980680213814916
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)N3NC[C@@H](C(=O)NCCC4=c5ccccc5=[NH+]C4)[C@@H]3N2)cc1OC,C63709806_decoy,WEE1,Decoy,0.0,-8.05441,-9.14,-4.05,-7.619547454639787
CSCC[C@@H](NC(=O)c1ccc(Br)cc1)C(=O)N1CCC2(CC1)NCCc1[nH]c[nH+]c12,C13551865_decoy,WEE1,Decoy,0.0,-11.2495,-5.85,-1.71,-7.00303965724248
CC(C)(C)CC(=O)Nc1nc2c(s1)C[C@@H]1[C@](C)(CO)[C@H](O)CC[C@@]1(C)[C@@H]2CC(=O)N1CCCCC1,C04236997_decoy,WEE1,Decoy,0.0,-10.4909,-7.63,-3.09,-7.626930495939764
C[C@H]1CCc2c(sc3ncnc(S[C@@H](C)C(=O)Nc4ccc(S(N)(=O)=O)cc4)c23)C1,C03522808_decoy,WEE1,Decoy,0.0,-10.5784,-9.74,-1.1,-8.835365919078338
C[C@H]1CCc2c(sc3ncnc(S[C@H](C)C(=O)Nc4ccc(S(N)(=O)=O)cc4)c23)C1,C03522810_decoy,WEE1,Decoy,0.0,-11.0747,-8.73,-0.43,-9.244721801207415
NC(=O)NC(=O)[C@@H](Sc1nnc(Cc2cccs2)n1C1CCCCC1)c1ccccc1,C08861256_decoy,WEE1,Decoy,0.0,-9.30668,-7.61,-1.13,-8.332661208542312
Cc1sc2ncn(CC(=O)Nc3sc4c(c3C(N)=O)CCCC4)c(=O)c2c1-c1ccc(F)cc1,C08920005_decoy,WEE1,Decoy,0.0,-9.27113,-10.69,-2.17,-8.985458627388656
NS(=O)(=O)c1cc(Cl)c(NC(=O)COC(=O)c2cc3c(s2)CCCCC3)c(Cl)c1,C09244465_decoy,WEE1,Decoy,0.0,-10.0279,-7.77,-0.62,-8.570878319130948
COc1cc(/C=N/NC(=O)[C@H](NC(=O)c2ccc(C)cc2)C(C)C)cc(Br)c1O,C10042106_decoy,WEE1,Decoy,0.0,-8.92254,-8.55,-1.12,-9.633096727472305
NC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCc4ccccc4C3)cc2)sc2c1CCCCC2,C04177332_decoy,WEE1,Decoy,0.0,-9.90325,-9.19,-1.41,-12.302246821145086
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1,C12378220_decoy,WEE1,Decoy,0.0,-8.68489,-9.18,-0.29,-16.538067317230325
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=S)NC(=O)c1ccc(Br)o1,C12570799_decoy,WEE1,Decoy,0.0,-10.4691,-7.12,-2.75,-9.813470511516751
Cc1cc(Br)ccc1OCC(=O)NNC(=S)NC(=O)c1ccc(Br)o1,C12570918_decoy,WEE1,Decoy,0.0,-9.62813,-7.83,-3.37,-8.939717731404224
C[C@@H]1CCc2sc(-c3nnc(SCC(=O)Nc4sc5c(c4C(N)=O)CCC5)o3)cc2C1,C12864958_decoy,WEE1,Decoy,0.0,-11.2289,-9.37,-5.2,-9.146291895458646
Nn1c(Cc2ccccc2F)nnc1SCC(=O)Nc1nc(-c2ccc(F)cc2)cs1,C13134113_decoy,WEE1,Decoy,0.0,-9.84449,-5.25,-1.43,-5.753215588391136
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1,C14018915_decoy,WEE1,Decoy,0.0,-10.3872,-6.0,-2.45,-5.508644338096102
Nc1c(N(Cc2ccccc2)C(=O)c2ccc(C(F)(F)F)cc2)c(=O)[nH]c(=O)n1Cc1ccccc1,C14383132_decoy,WEE1,Decoy,0.0,-6.73024,-6.11,-3.71,-4.584496814371519
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)cc2)cc1C,C14393539_decoy,WEE1,Decoy,0.0,-8.28476,-10.38,-3.14,-7.204497733176553
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3cccc(C(=O)NC4CC4)c3)cc2)cc1C,C14482279_decoy,WEE1,Decoy,0.0,-8.66491,-10.65,-4.98,-8.241419355003707
CNC(=O)c1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc(Br)s3)cc2)cc1,C15560659_decoy,WEE1,Decoy,0.0,-9.64672,-9.25,-2.19,-10.862662610651563
COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)c(Cl)c(Br)c1O,C01148530_decoy,WEE1,Decoy,0.0,-7.08995,-6.07,-0.07,-4.186773493725352
Cc1cccc(C)c1NC(=O)CNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1,C17857125_decoy,WEE1,Decoy,0.0,-10.1673,-9.66,-3.54,-9.572259133141204
CC1=C(C(=O)Nc2c(C)cccc2C)[C@@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2ccccc2)N1,C12250161_decoy,WEE1,Decoy,0.0,-7.42783,-4.22,-2.48,-4.27129434593454
Nn1c(N/N=C/c2ccc(Cl)cc2)nnc1SCC(=O)c1ccc(Br)cc1,C20528278_decoy,WEE1,Decoy,0.0,-9.31662,-8.46,-2.07,-11.623478077663302
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1,C21000889_decoy,WEE1,Decoy,0.0,-10.6729,-9.8,-3.77,-8.697573100114058
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Cl)s1,C21000919_decoy,WEE1,Decoy,0.0,-9.84033,-8.18,-1.53,-8.965698074671307
C[C@H](NC(=O)COC(=O)c1cc(S(N)(=O)=O)ccc1Br)C12CC3CC(CC(C3)C1)C2,C21463952_decoy,WEE1,Decoy,0.0,-10.0841,-8.24,-2.93,-8.943817622729101
CCSc1nn(CC(=O)Nc2ccc(Cl)cc2)c(N)c1S(=O)(=O)c1ccc(C)cc1,C21911048_decoy,WEE1,Decoy,0.0,-9.39406,-8.1,-3.81,-8.017655855083605
C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cccc(NC(=O)c2cccs2)c1,C22906236_decoy,WEE1,Decoy,0.0,-8.00493,-9.61,-4.09,-8.607772715248023
O=C(Nc1ccccc1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc(Cl)cc1,C24639400_decoy,WEE1,Decoy,0.0,-9.66829,-5.43,-1.3,-5.839306456922041
CC(=O)Nc1ccc(CNC(=O)c2ccc(C)c(NS(=O)(=O)c3c(C)cc(C)cc3C)c2)cc1,C25339827_decoy,WEE1,Decoy,0.0,-6.61896,-9.36,-2.76,-6.66915338606938
CC[C@@H](Sc1ccc2ccccc2n1)C(=O)Nc1nc2ccc(S(N)(=O)=O)cc2s1,C32528120_decoy,WEE1,Decoy,0.0,-10.812,-7.88,-0.87,-7.686222170221241
CC(=O)Nc1ccc(C)cc1S(=O)(=O)Nc1ccc(C2(C(=O)NC3CCC(C)CC3)CC2)cc1,C33274678_decoy,WEE1,Decoy,0.0,-9.37345,-8.12,-4.17,-7.988090636101504
C[C@@H]1C[C@H]2[C@@H]3CCC4=Cc5c(cnn5-c5ccc(F)nc5)C[C@]4(C)[C@@H]3[C@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,C34210886_decoy,WEE1,Decoy,0.0,-6.95719,-5.38,-2.22,-4.011623605132683
COc1ccc(-c2nn(-c3ccc(C(F)(F)F)cc3)c(N)c2NC(=O)N2CCSCC2)cc1,C34786042_decoy,WEE1,Decoy,0.0,-8.69249,-5.84,-1.66,-5.357309055632654
O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc(N2CCCC2)c(C(=O)NC[C@H]2CCCO2)c1,C35265306_decoy,WEE1,Decoy,0.0,-8.55947,-9.32,-1.27,-8.065885082944579
COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc(Br)c1OCc1ccc(C)cc1,C35316329_decoy,WEE1,Decoy,0.0,-8.98556,-9.66,-1.51,-9.557879316271196
CC(=O)Nc1ccc(-c2csc(NC(=O)[C@@H](NC(=O)c3ccc(Cl)cc3)C(C)C)n2)cc1,C36630733_decoy,WEE1,Decoy,0.0,-9.34775,-6.96,-2.04,-6.183907902899203
C=CCOc1ccc([C@H]2C(C#N)=C(N)N(Nc3ccccc3)C3=C2C(=O)CC(C)(C)C3)cc1OC,C02170042_decoy,WEE1,Decoy,0.0,-10.2356,-8.16,-1.44,-8.90615089431645
CC1(C)C(=O)N(C2[C@@H]3CC4C[C@H]2CC(/C(N)=N/O)(C4)C3)C[C@H]1COc1ccc(C(F)(F)F)cn1,C36286258_decoy,WEE1,Decoy,0.0,-8.2269,-7.98,-1.39,-7.012546839889875
Cc1ccc2c(c1)[C@@]1(N[C@H](Cc3c[nH]c4ccccc34)[C@@H]3C(=O)N(c4ccc(F)cc4)C(=O)[C@@H]31)C(=O)N2,C15972856_decoy,WEE1,Decoy,0.0,-8.09216,-7.09,-1.18,-4.903256154211704
Cc1ccc(NC(=O)[C@H](C)NC(=O)C2CCCC2)cc1S(=O)(=O)Nc1ccc(Cl)cc1,C46899652_decoy,WEE1,Decoy,0.0,-9.39645,-9.44,-3.23,-8.91664114560068
Cc1ccc2c(c1)[C@@]1(N[C@@H](Cc3c[nH]c4ccccc34)[C@H]3C(=O)N(c4ccc(F)cc4)C(=O)[C@H]31)C(=O)N2,C26817032_decoy,WEE1,Decoy,0.0,-9.04311,-6.93,-1.83,-5.494352067004583
Cc1ccc(NC(=S)N/N=C\c2c[nH]c3ccc(S(=O)(=O)N4CCCCC4)cc23)cc1,C58095081_decoy,WEE1,Decoy,0.0,-8.99561,-9.07,-1.9,-12.87902893420837
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NCC(=O)Nc1ccccc1C(=O)NC1CC1,C58323585_decoy,WEE1,Decoy,0.0,-7.85855,-9.07,-3.6,-7.146394529936105
C[C@@H](NC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1)c1cccc(NC(=O)c2ccccc2)c1,C58821561_decoy,WEE1,Decoy,0.0,-9.82008,-10.07,-2.98,-8.59670490967744
[H]/N=C1\S[C@H](C(=O)Nc2ccc(Br)cc2)CC(=O)N1/N=C/c1c(O)ccc2ccccc12,C58836599_decoy,WEE1,Decoy,0.0,-8.85059,-10.1,-1.18,-8.23455999160915
O=C(CSc1n[nH]c(N/N=C/c2ccc(Cl)cc2)n1)Nc1ccc(Br)cc1,C59015208_decoy,WEE1,Decoy,0.0,-9.17507,-9.43,-2.08,-9.717840383172122
C/C(=N\Nc1nc(SCC(=O)Nc2ccc(C)cc2Br)n[nH]1)c1cccs1,C59038781_decoy,WEE1,Decoy,0.0,-11.0669,-8.04,-1.75,-8.611765382063762
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)c1ccc(NC(=O)c2cccs2)cc1,C60034001_decoy,WEE1,Decoy,0.0,-8.65,-4.89,-0.9,-5.706133104727937
COc1cc(Br)c(NC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)cc1OC,C62569564_decoy,WEE1,Decoy,0.0,-8.64147,-8.58,-2.66,-7.66017263988455
COc1cc([C@H]2C(C#N)=C(N)OC3=NN=C(c4ccc(Br)cc4)[C@H]32)cc(Cl)c1O,C00718464_decoy,WEE1,Decoy,0.0,-8.57478,-4.83,-1.7,-4.441443003978081
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)C1=C[C@@H](NC(=O)c2ccc(SC)cc2OC)[C@@H](O)[C@H](O)C1,C04151687_decoy,WEE1,Decoy,0.0,-10.737,-8.79,-2.99,-12.60165070780367
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)Nc3nc4ccc(S(N)(=O)=O)cc4s3)cc2)C[C@@H](C)O1,C03166611_decoy,WEE1,Decoy,0.0,-9.50877,-9.98,-1.39,-13.076461255174555
COC(=O)C[C@H]1SC2=C(C(=O)Nc3cccc(C)c3)[C@@H](c3cccc(F)c3)C(C#N)=C(N)N2C1=O,C03770428_decoy,WEE1,Decoy,0.0,-8.03551,-4.3,-2.25,-5.066230735892798
COC(=O)C[C@@H]1SC2=C(C(=O)Nc3cccc(C)c3)[C@H](c3cccc(F)c3)C(C#N)=C(N)N2C1=O,C03770429_decoy,WEE1,Decoy,0.0,-9.2931,-6.85,-2.07,-8.289285827336284
CC(=O)Nc1cccc(NC(=O)CSc2nnc(NC(=O)c3cccc(Br)c3)s2)c1,C08822591_decoy,WEE1,Decoy,0.0,-10.404,-8.77,-2.29,-8.896539369848725
NC(=O)c1ccc(-c2nnn(CC(=O)Nc3sc4c(c3C(=O)c3ccccc3)CCCC4)n2)cc1,C08935649_decoy,WEE1,Decoy,0.0,-10.6292,-10.34,-5.49,-9.562101266587016
C[C@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1)C(=O)Nc1ccc(S(N)(=O)=O)cc1,C09182676_decoy,WEE1,Decoy,0.0,-9.0068,-9.25,-3.3,-9.004826482006553
COC(=O)c1sc(NC(=O)c2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2)c(C(N)=O)c1C,C09472353_decoy,WEE1,Decoy,0.0,-9.99076,-9.59,-2.11,-9.154829552548144
O=C(CNC(=O)c1ccc(Br)o1)Nc1cccc(S(=O)(=O)/N=C2\CCCCCN2)c1,C10021522_decoy,WEE1,Decoy,0.0,-9.41899,-8.31,-2.71,-7.809084680651813
CC(C)Sc1nnc(N2C(N)=C(C#N)[C@]3(C(=O)Nc4ccc(F)cc43)C3=C2CC(C)(C)CC3=O)s1,C12401668_decoy,WEE1,Decoy,0.0,-9.39301,-5.42,-2.2,-5.1276790972344
CC(C)Sc1nnc(N2C(N)=C(C#N)[C@@]3(C(=O)Nc4ccccc43)C3=C2CC(C)(C)CC3=O)s1,C12401671_decoy,WEE1,Decoy,0.0,-8.75069,-5.52,-0.8,-4.964495346953491
CCSc1nnc(N2C(N)=C(C#N)[C@]3(C(=O)Nc4ccccc43)C3=C2CC(C)(C)CC3=O)s1,C12412585_decoy,WEE1,Decoy,0.0,-8.2171,-5.71,-2.27,-4.535149621056451
O=C(CN1C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C1=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1,C12530333_decoy,WEE1,Decoy,0.0,-6.55702,-6.58,-3.24,-4.329646069327534
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)Nc1sc2c(c1C(N)=O)CCC2,C13137740_decoy,WEE1,Decoy,0.0,-9.05257,-8.32,-1.07,-11.683536816779169
Cc1ccc(C(=O)NC(=S)NNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1Br,C13630184_decoy,WEE1,Decoy,0.0,-8.93448,-8.47,-3.35,-7.470893254051584
NC(=O)c1c(NC(=O)c2cnn3c(C(F)(F)F)cc(-c4ccco4)nc23)sc2c1CCCC2,C02780773_decoy,WEE1,Decoy,0.0,-9.62445,-9.28,-1.3,-9.452201174775738
NS(=O)(=O)c1ccc2nc(NC(=O)[C@H]3CCCN(S(=O)(=O)c4ccc(Cl)cc4)C3)sc2c1,C14015684_decoy,WEE1,Decoy,0.0,-8.75724,-6.15,-3.58,-4.797080994133525
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)NCCc5c[nH]cn5)CC[C@@]4(C)[C@@H]3CC[C@@]21C,C16036757_decoy,WEE1,Decoy,0.0,-9.83428,-8.6,-2.47,-7.715204613055164
Cc1ccc(S(=O)(=O)NNC(=O)c2sc(NS(=O)(=O)c3ccc(C)cc3)nc2C)cc1,C16847568_decoy,WEE1,Decoy,0.0,-10.4882,-11.05,-2.43,-12.676202443107702
COC(=O)C[C@H]1SC2=C(C(=O)Nc3ccc(C)cc3C)[C@@H](c3ccc(F)cc3)C(C#N)=C(N)N2C1=O,C03770067_decoy,WEE1,Decoy,0.0,-8.69373,-4.47,-1.17,-5.396325902402223
COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(CCc4c[nH]cn4)c(=O)c32)cc(Br)c1OC,C18201161_decoy,WEE1,Decoy,0.0,-9.7481,-4.96,-0.69,-6.052936112493244
CC(=O)Nc1ccc(NC(=O)CSc2nc([O-])c3c(n2)CC[NH+](Cc2ccc(F)cc2)C3)cc1,C21810410_decoy,WEE1,Decoy,0.0,-9.20484,-8.56,-2.35,-7.437990513886812
O=C(Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1cccc(NC(=O)[C@H]2CCCO2)c1,C22968282_decoy,WEE1,Decoy,0.0,-8.49656,-10.32,-2.39,-8.149503857498749
NC(=O)c1ccc(N2CCCCC2)c(NC(=O)[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1,C23009445_decoy,WEE1,Decoy,0.0,-10.0535,-8.85,-2.25,-9.707293998926446
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)c1cc(Br)c[nH]1,C24123455_decoy,WEE1,Decoy,0.0,-8.0945,-9.75,-2.02,-8.460102874583312
NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)Nc2cc(Cl)ccc2Sc2ccc(F)cc2)c1=O,C27055344_decoy,WEE1,Decoy,0.0,-8.65144,-7.83,-3.88,-7.891881641168875
Cc1nc(-c2c[nH]c(C(=O)Nc3ccc(NS(=O)(=O)c4cc([N+](=O)[O-])ccc4C)cc3)c2)cs1,C29635521_decoy,WEE1,Decoy,0.0,-9.90123,-9.83,-2.59,-7.943616706587137
CC(C)=C1SC(=O)N/C1=N/N=C1\NC(=O)[C@H](CC(=O)Nc2ccc(Br)cc2)S1,C16779024_decoy,WEE1,Decoy,0.0,-9.46214,-7.91,-1.81,-8.819699018768295
C[C@H](Sc1nnc(-c2ccco2)n1-c1ccccc1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C09209200_decoy,WEE1,Decoy,0.0,-8.78034,-8.0,-1.14,-13.254092488386306
CC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cc1,C32970967_decoy,WEE1,Decoy,0.0,-9.26644,-9.25,-2.26,-7.526294661111956
CC(=O)N1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(C)C4CCCCC4)cc3)c2C(N)=O)C1,C03007298_decoy,WEE1,Decoy,0.0,-10.6118,-9.43,-1.11,-9.03851186310209
Cc1csc(NC(=O)CS[C@H]2N=N[C@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2ccc(F)cc2)n1,C39362868_decoy,WEE1,Decoy,0.0,-9.54111,-8.15,-1.13,-8.11517830352632
Cc1oc2nc(SCC(=O)NC(=O)NCc3ccco3)nc(NC(=O)c3ccccc3)c2c1C,C39553943_decoy,WEE1,Decoy,0.0,-9.70977,-10.06,-2.7,-10.451152787084055
NN1[C@@H](SCC(=O)Nc2ccc(Br)cc2F)N=N[C@H]1[C@H]1C=C(c2ccc(F)cc2)N=N1,C39592670_decoy,WEE1,Decoy,0.0,-9.79058,-8.89,-2.74,-8.94391258022948
NN1[C@@H](SCC(=O)Nc2ccc(Br)cc2F)N=N[C@@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C39592681_decoy,WEE1,Decoy,0.0,-9.34832,-9.25,-2.63,-8.773285447687543
O=C([O-])C[C@@H](NC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)c1ccccc1,C39682573_decoy,WEE1,Decoy,0.0,-9.17717,-6.83,-2.24,-6.934091863735287
C[C@@H]1C[C@@H](C)CN(c2nc3c(c(=O)[nH]2)[C@@H](C(=O)Nc2ccc(Br)cc2)CC(=O)N3)C1,C40383414_decoy,WEE1,Decoy,0.0,-8.17934,-6.61,-1.8,-5.9376218337284525
C#CCN(C)C(=O)C[C@@H]1c2nc(NC(=O)c3ccc(OC)cc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553326_decoy,WEE1,Decoy,0.0,-10.7817,-8.76,-2.25,-8.451100471926553
CC(=O)[C@]1(O)CC[C@H]2[C@H]3CCC4=C/C(=N\OCC(=O)N[C@H]5CCCCNC5=O)CC[C@@]4(C)[C@@H]3CC[C@]21C,C43737069_decoy,WEE1,Decoy,0.0,-10.0302,-8.95,-1.96,-8.460836045445424
COc1ccc(C(=O)Nc2[nH+]cccc2[O-])cc1S(=O)(=O)Nc1ccc(Br)cc1,C22264597_decoy,WEE1,Decoy,0.0,-9.28447,-9.39,-2.51,-9.419836658930317
CCOC(=O)N1CCc2c(sc3c2C(O)=N[C@@H](c2cc(Br)cc(OC)c2O)N3)C1,C08921148_decoy,WEE1,Decoy,0.0,-9.85401,-9.39,-0.86,-13.199393344977006
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1,C13121528_decoy,WEE1,Decoy,0.0,-9.76185,-9.9,-3.95,-7.291417370172298
CC(=O)Nc1ccc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@H](c2ccc4c(c2)OCO4)N3)cc1,C01326716_decoy,WEE1,Decoy,0.0,-8.06637,-9.69,-3.95,-6.579881433015151
CC(=O)Nc1ccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@H](c2ccc4c(c2)OCO4)N3)cc1,C01326712_decoy,WEE1,Decoy,0.0,-8.37512,-10.99,-2.57,-8.393998860819972
COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)/C2=C(\C)NCc2ccc(S(N)(=O)=O)cc2)cc1,C20288661_decoy,WEE1,Decoy,0.0,-9.01958,-7.36,-3.63,-6.258179533834811
CN(C)C(=O)CCSc1n[nH]c(N/N=C/c2cc(Br)c(O)c(Br)c2)n1,C59818992_decoy,WEE1,Decoy,0.0,-10.9647,-7.4,-0.8,-8.398803509163875
COc1ccc2c(c1)=C1CCN[C@H](c3c([O-])n(-c4ccc(Br)cc4)c(=O)[nH]c3=O)[C@H]1[NH+]=2,C63373451_decoy,WEE1,Decoy,0.0,-8.03172,-8.46,-0.65,-6.978683349678412
CCOC(=O)c1ccc(-n2c(=O)[nH]c([O-])c([C@H]3NCCC4=c5cc(OC)ccc5=[NH+][C@@H]43)c2=O)cc1,C63376042_decoy,WEE1,Decoy,0.0,-8.50685,-10.17,-0.63,-8.174281942749003
CC[C@H](C)NC(=O)c1cc([N-]S(=O)(=O)c2ccc(Br)cc2)cnc1N1CC[NH2+]CC1,C35513904_decoy,WEE1,Decoy,0.0,-9.46906,-8.34,-2.62,-7.668065463994319
CC(C)NC(=O)c1cc([N-]S(=O)(=O)c2ccc(Br)s2)cnc1N1CC[NH2+]CC1,C65025204_decoy,WEE1,Decoy,0.0,-9.92742,-7.61,-0.45,-9.378778117471128
Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3cc([N+](=O)[O-])ccc3[O-])C2=O)cc1,C01797646_decoy,WEE1,Decoy,0.0,-9.02833,-8.54,-3.04,-7.726627867169522
CSC[C@H](NC(=O)Cc1c(C)c2cc3c(cc2oc1=O)OC1(CCCCC1)CC3)C(=O)[O-],C09484891_decoy,WEE1,Decoy,0.0,-9.94045,-9.35,-2.22,-13.862864447761774
C[C@]12C=C/C(=N\OCC(=O)N3CCC[C@@H]3C(=O)[O-])C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O,C12878223_decoy,WEE1,Decoy,0.0,-8.59365,-8.37,-2.14,-8.79891152488773
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1C,C13028806_decoy,WEE1,Decoy,0.0,-8.63387,-9.23,-1.43,-8.31073628673413
C[C@@H](Oc1ccc(C2=C[C@H](c3ccc(F)c(Br)c3)n3nnnc3N2)cc1)C(=O)[O-],C13077350_decoy,WEE1,Decoy,0.0,-9.1033,-9.96,-1.94,-9.626695261982457
COc1cc(NC(=O)c2ccc(S(=O)(=O)N3CCCC[C@@H]3C)cc2)c(C(=O)[O-])cc1OC,C13169088_decoy,WEE1,Decoy,0.0,-8.51936,-9.79,-3.78,-8.058251767142755
Cc1ccc([C@H](CC(=O)[O-])NC(=O)C2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1,C13180572_decoy,WEE1,Decoy,0.0,-8.69491,-9.24,-2.31,-11.818439662816656
CN(CC(=O)Nc1ccccc1C(=O)[O-])C(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1,C13184045_decoy,WEE1,Decoy,0.0,-7.98838,-9.93,-4.07,-9.750054789234673
C/C(=N\NC(=O)c1cn(C)c2ccccc12)c1ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)cc1,C13186898_decoy,WEE1,Decoy,0.0,-8.06969,-9.39,-3.27,-7.045687514071973
Cc1ccc(-c2nnc(SCC(=O)Nc3ccc4c(c3)OC(F)(F)O4)n2CC(=O)[O-])cc1,C13205340_decoy,WEE1,Decoy,0.0,-7.79271,-9.46,-2.14,-10.5122638714864
Cc1cccc(-c2nnc(SCC(=O)Nc3ccc4c(c3)OC(F)(F)O4)n2CC(=O)[O-])c1,C13205394_decoy,WEE1,Decoy,0.0,-7.57537,-9.19,-2.95,-6.945245695471157
CC(=O)N1CCc2cc(NC(=O)CSc3nnc(-c4ccc(C)cc4)n3CC(=O)[O-])ccc21,C13206060_decoy,WEE1,Decoy,0.0,-8.6139,-9.54,-0.77,-14.635402996624604
C[C@@H](Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1)c1ccc(F)c(F)c1,C13211872_decoy,WEE1,Decoy,0.0,-8.6258,-7.69,-4.3,-4.576224047031285
Cc1cc(C(=O)[O-])cc(S(=O)(=O)N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1C,C13312220_decoy,WEE1,Decoy,0.0,-8.46524,-9.43,-1.93,-6.816930168883019
Cc1cc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)[O-])c(C)n1C[C@@H]1COc2ccccc2O1,C13363058_decoy,WEE1,Decoy,0.0,-7.60668,-9.38,-2.26,-12.243773881303063
COc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1C(=O)[O-],C13392627_decoy,WEE1,Decoy,0.0,-8.45551,-10.37,-2.47,-2.8617993321686344
CSc1ccc(/C=C/C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C(=O)[O-])C3)cc2)cc1,C13395772_decoy,WEE1,Decoy,0.0,-9.62378,-9.71,-2.67,-8.2539213160202
O=C([O-])[C@H]1CCCN(S(=O)(=O)c2ccc(NC(=O)C3(c4ccccc4)CCCC3)cc2)C1,C13395968_decoy,WEE1,Decoy,0.0,-7.94928,-8.53,-1.59,-7.367732891154003
O=C(Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)[O-])C2)cc1)c1cc(F)c(F)c(F)c1F,C13396353_decoy,WEE1,Decoy,0.0,-8.79247,-7.53,-2.36,-5.739479235711819
O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)[O-])C2)cc1)c1ccc(N2CCCC2=O)cc1,C13398013_decoy,WEE1,Decoy,0.0,-8.54622,-9.49,-1.78,-7.459300955093699
O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)[O-])C2)cc1)c1cccc(N2CCCC2=O)c1,C13398400_decoy,WEE1,Decoy,0.0,-9.82888,-10.25,-0.25,-8.81197273755571
O=C([O-])/C=C/c1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc3c(c2)OCCO3)cc1,C13404147_decoy,WEE1,Decoy,0.0,-9.9183,-10.45,-3.05,-8.896937191160056
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)C3CCN(C(=O)C(C)(C)C)CC3)cc2)n1,C20612748_decoy,WEE1,Decoy,0.0,-8.34716,-8.76,-2.9,-7.577268888127064
C[C@@H]1Cc2cc(-c3cc(C(=O)Nc4ccc(S(=O)(=O)[N-]c5nccs5)cc4)no3)ccc2O1,C21786099_decoy,WEE1,Decoy,0.0,-8.91176,-9.23,-1.47,-7.444314178978558
Cc1ccc(-c2nnc([S-])n2CC(=O)Nc2nc(CN3C[C@@H](C)O[C@@H](C)C3)cs2)cc1,C25059818_decoy,WEE1,Decoy,0.0,-9.57976,-8.99,-1.75,-9.734797262849822
C[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1)c1ccc2c(c1)OCCCO2,C32284904_decoy,WEE1,Decoy,0.0,-9.06349,-5.57,-2.36,-5.803659885809937
CN(C)C(=O)c1ccc(NC(=O)c2ccccc2[N-]S(=O)(=O)c2ccc(Cl)cc2)cc1,C32273124_decoy,WEE1,Decoy,0.0,-8.52314,-9.12,-2.87,-7.999672607467245
CC(=O)N[C@@H]1[C@H](Oc2ccccc2)O[C@H]2CO[C@@H](c3ccccc3)O[C@@H]2[C@@H]1O[C@@H](C)C(=O)[O-],C35056988_decoy,WEE1,Decoy,0.0,-6.70037,-5.51,-1.67,-4.213629041601659
CC(=O)N[C@@H]1[C@H](OCC(=O)[O-])[C@H]2O[C@@H](c3ccccc3)OC[C@H]2O[C@@H]1Sc1ccccc1,C35057795_decoy,WEE1,Decoy,0.0,-6.5267,-6.16,-3.52,-3.767209259130631
CC(=O)N[C@@H]1[C@@H](OCC(=O)[O-])[C@H]2O[C@@H](c3ccccc3)OC[C@H]2O[C@@H]1Sc1ccccc1,C35057802_decoy,WEE1,Decoy,0.0,-5.80244,-4.7,-6.19,-2.803896578960176
Cc1ccc(-c2noc(CCC(=O)Nc3ccc4nc([N-]S(C)(=O)=O)sc4c3)n2)cc1,C21883079_decoy,WEE1,Decoy,0.0,-9.65233,-9.11,-2.43,-8.734086140990179
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccccc1C(=O)N1CCN(c2ccc(Cl)cc2)CC1,C00627478_decoy,WEE1,Decoy,0.0,-7.4935,-6.24,-1.35,-5.085824023240334
O=C(NCc1nnc([S-])n1-c1ccccc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1,C13544014_decoy,WEE1,Decoy,0.0,-8.4236,-6.27,-1.63,-5.967414713053844
Cc1ccc2c(=O)cc(C(=O)Nc3ccc(S(=O)(=O)[N-]c4onc(C)c4C)cc3)oc2c1C,C08606761_decoy,WEE1,Decoy,0.0,-8.22693,-9.26,-2.09,-6.647170039313116
Cc1nc(-n2nc(-c3cccs3)cc2NC(=O)c2ccccc2S(=O)(=O)C(F)F)nc([O-])c1C,C38740694_decoy,WEE1,Decoy,0.0,-8.88729,-8.39,-2.63,-9.410266238123166
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)[C@@H](C)Sc1nnc2nc([O-])cc(C)n12,C39389428_decoy,WEE1,Decoy,0.0,-9.13584,-5.64,-2.04,-6.519458648342051
O=C1C[C@@H](F)Nc2c1n(-c1ccccc1[O-])c(=O)c1cc(S(=O)(=O)Oc3ccccc3)cnc21,C39450617_decoy,WEE1,Decoy,0.0,-8.27265,-8.52,-2.33,-8.73173531687849
Cc1c(C(=O)[O-])sc2nc(CSC3=N[C@H]4SC5=C(CCCC5)[C@H]4C(=O)N3C)[nH]c(=O)c12,C39680040_decoy,WEE1,Decoy,0.0,-8.60063,-8.73,-0.75,-8.10148846678824
COc1ccccc1Nc1nnc(SCC2=NC(=O)C3=C(C)[C@@H](C(=O)[O-])SC3=N2)s1,C39691403_decoy,WEE1,Decoy,0.0,-9.31605,-8.37,-1.26,-9.843798510768323
CCN1C(=O)[C@H]2C3=C(CCCC3)S[C@H]2N=C1SCc1nc2sc(C(=O)[O-])c(C)c2c(=O)[nH]1,C39691976_decoy,WEE1,Decoy,0.0,-9.44581,-8.85,-0.89,-7.739738716875209
Cc1cccc(NC(=O)CN2CCN(S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)CC2)c1C,C13089074_decoy,WEE1,Decoy,0.0,-9.24384,-8.19,-3.73,-7.993509276431283
CCC1=C(C)S[C@H]2N=C(SCc3nc4sc(C(=O)[O-])c(C)c4c(=O)[nH]3)N(CC)C(=O)[C@H]12,C39724243_decoy,WEE1,Decoy,0.0,-10.752,-7.69,-2.12,-7.089910108852725
O=C(C1=C([O-])C(=O)N(CCO)[C@H]1c1cccc(Oc2ccccc2)c1)c1ccc2c(c1)OCCO2,C40096525_decoy,WEE1,Decoy,0.0,-7.89077,-9.37,-1.5,-7.844475813960687
O=C(C1=C([O-])C(=O)N(CCO)[C@H]1c1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1,C40111638_decoy,WEE1,Decoy,0.0,-7.96147,-7.76,-1.88,-6.427428430445657
C=CCn1c(SCc2nc3oc(C)c(C(=O)[O-])c3c(=O)[nH]2)nc2sc3c(c2c1=O)CCCC3,C13416068_decoy,WEE1,Decoy,0.0,-8.19923,-8.8,-3.64,-7.645299237733062
COc1ccc([C@H]2CC(=O)Nc3c(C(=O)[O-])cn(-c4ccc(Cl)cc4)c32)c(OC)c1OC,C49546823_decoy,WEE1,Decoy,0.0,-7.28712,-5.48,-3.01,-4.95663737636812
COc1ccc(/C([O-])=N/c2nc(-c3ccc(F)cc3)n[nH]2)cc1S(=O)(=O)N1CCCCCC1,C13018846_decoy,WEE1,Decoy,0.0,-9.18638,-9.89,-1.12,-9.002270406562696
CC(=O)c1ccc(NC(=O)CSC2=C(C#N)[C@H](c3ccc(C)o3)C3=C([O-])CCCC3=N2)cc1,C02310865_decoy,WEE1,Decoy,0.0,-9.1303,-10.27,-2.76,-9.455393485807097
O=C1N=C([O-])N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(S[C@H]2N=C3C=CC=C[C@@H]3N2)o1,C39275888_decoy,WEE1,Decoy,0.0,-9.71885,-9.94,-1.06,-8.603360451273165
CC(=O)Nc1c(C)cc(C)cc1-c1nnc(S[C@@H](C)C(=O)N2CCc3ccccc32)nc1[O-],C64774544_decoy,WEE1,Decoy,0.0,-8.62044,-9.37,-2.21,-7.886002088304001
Cc1ccc(C2=N[C@@H](c3ccc(Cl)c([N+](=O)[O-])c3)[NH2+][C@@H](c3cc(Br)ccc3O)C2)cc1,C02936370_decoy,WEE1,Decoy,0.0,-8.63764,-10.32,-1.52,-8.12515842255003
C[C@@H]1CCC[NH+](CC(=O)Nc2sc3c(c2C(=O)Nc2ccc(Br)cc2)CCC3)C1,C00729083_decoy,WEE1,Decoy,0.0,-10.3952,-8.78,-4.09,-11.477595705482791
Cc1cc(N2C[C@H](C)C[C@@H](C)C2)[nH+]c2ccc(NC(=O)CCC(=O)NC3CCCCCC3)cc12,C09598432_decoy,WEE1,Decoy,0.0,-10.3613,-9.85,-4.2,-8.300570222128092
O=C(CC1CCCC1)Nc1cccc(N2CCC([NH2+]C[C@@H]3CCCN(c4ncccn4)C3)CC2)c1,C12206295_decoy,WEE1,Decoy,0.0,-9.81155,-7.7,-2.45,-8.777747535367416
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH+]4CCC([C@@H](O)c5ccccc5)CC4)CC3)cc2)c(C)c1,C12453581_decoy,WEE1,Decoy,0.0,-9.32601,-10.3,-2.49,-7.794261949403772
COc1ccc([C@H](NC(=O)C[NH+]2CCC(C(=O)Nc3ccccc3)CC2)c2ccccc2)cc1,C12691969_decoy,WEE1,Decoy,0.0,-9.26821,-9.95,-3.65,-11.323404272997534
Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)cc1,C12556453_decoy,WEE1,Decoy,0.0,-9.20328,-9.04,-3.74,-9.2861259613062
COc1ccc([C@@H]2[C@@H]3CCCC[C@@]3(O)CC[NH+]2CC(=O)Nc2ccc(Cl)cc2Cl)c(OC)c1,C13768980_decoy,WEE1,Decoy,0.0,-9.38532,-5.02,-2.8,-5.711904231255384
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH2+]CC4(c5ccccc5)CCOCC4)CC3)cc2)c(C)c1,C15003056_decoy,WEE1,Decoy,0.0,-9.43804,-8.58,-3.73,-9.681709674307502
CCc1ccccc1NC(=O)c1c(NC(=O)C[NH+]2CCCC[C@@H]2CC)sc2c1CCCCC2,C15946760_decoy,WEE1,Decoy,0.0,-9.92789,-9.11,-4.03,-9.976249135414882
COc1ccc(OC)c([C@@H]2[C@@H]3CCCC[C@@]3(O)CC[NH+]2CC(=O)Nc2ccc(Cl)cc2Cl)c1,C02204880_decoy,WEE1,Decoy,0.0,-9.47188,-4.69,-3.26,-4.6203275766041525
Cc1ccc(NC(=O)N[C@H](CCC(C)C)c2c(-n3cccc3)sc3c2CC[NH+](C)C3)cc1F,C20532169_decoy,WEE1,Decoy,0.0,-7.74125,-4.37,-3.94,-4.463809920661691
CC(C)NC(=O)[C@@H]1C[C@@H](Sc2nc3ccccc3[nH]2)C[NH+]1C/C(Cl)=C/c1ccccc1,C20908693_decoy,WEE1,Decoy,0.0,-9.10005,-6.18,-3.28,-7.10250578532141
Cc1ccc(-n2ncc(C(=O)Nc3ccc(Br)cc3F)c2C2CC[NH2+]CC2)cc1C,C20940882_decoy,WEE1,Decoy,0.0,-8.96675,-5.84,-1.43,-5.969413434493174
CC1CC[NH+]([C@H](CNC(=O)[C@@H](NC(=O)c2c(F)cccc2F)C(C)C)c2cccs2)CC1,C25382053_decoy,WEE1,Decoy,0.0,-9.21509,-7.93,-3.86,-8.641538114033162
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(NC(=O)C[C@@H](C)CC(C)(C)C)cc2)N2CCCSC2=[NH+]1,C33436976_decoy,WEE1,Decoy,0.0,-9.41418,-8.7,-4.3,-5.644964543544979
O=C(Nc1cccc(Cl)c1Cl)C1=CC2=[NH+][C@@H](c3ccc(Cl)cc3)C[C@@H](C(F)(F)F)N2N1,C03011885_decoy,WEE1,Decoy,0.0,-8.38609,-10.49,-3.04,-7.79979551971322
COc1ccc(NC(=O)C2=CC3=[NH+][C@@H](c4ccc(Cl)cc4)C[C@@H](C(F)(F)F)N3N2)cc1Cl,C03011938_decoy,WEE1,Decoy,0.0,-8.16541,-10.05,-2.57,-7.487367868933467
O=C(NC1CCCCC1)C1=CC2=[NH+][C@@H](c3ccc(Br)cc3)C[C@H](C(F)(F)F)N2N1,C00647518_decoy,WEE1,Decoy,0.0,-8.49052,-5.86,-2.96,-5.34557613918316
Cc1c(Cl)cccc1NC(=O)C1=CC2=[NH+][C@@H](c3ccc(Cl)cc3)C[C@@H](C(F)(F)F)N2N1,C03011436_decoy,WEE1,Decoy,0.0,-8.06179,-10.65,-1.9,-8.404767924163654
Cc1cccc(N[C@@H](c2ccc(C(F)(F)F)cc2)c2cc(C)sc2NC(=O)c2ccco2)[nH+]1,C38547000_decoy,WEE1,Decoy,0.0,-8.39585,-7.82,-2.82,-7.213325566058034
Cc1cc[nH+]c(N[C@H](c2ccc(C(F)(F)F)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547620_decoy,WEE1,Decoy,0.0,-11.0122,-5.46,-2.94,-7.129745109513476
C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1)[C@@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1,C38597410_decoy,WEE1,Decoy,0.0,-9.70049,-9.15,-3.48,-6.481064308981311
COC(=O)c1c(NC(=O)c2ccc(Cc3ccccc3)cc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C38806059_decoy,WEE1,Decoy,0.0,-9.79278,-10.77,-2.02,-12.057290170384436
COC(=O)c1c(NC(=O)CC(c2ccccc2)c2ccccc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C38806156_decoy,WEE1,Decoy,0.0,-9.03746,-7.75,-1.25,-7.930072526017251
O=C1[NH+]=c2ccccc2=C(c2ccccc2)[C@H]1S[C@H]1NN[C@H](c2cccs2)N1c1ccccc1,C39330106_decoy,WEE1,Decoy,0.0,-9.74342,-4.84,-3.31,-5.042164388096243
O=S(=O)(Oc1ccccc1)c1cc(Cc2ccccc2)ccc1N1CC[NH2+][C@H](c2ccccc2O)C1,C39530366_decoy,WEE1,Decoy,0.0,-9.337,-9.7,-3.36,-9.165887586167573
CC[C@@H](C(=O)N1C[C@H](C(=O)NCCc2ccc(C)cc2C)C2(CC[NH2+]CC2)C1)c1ccccc1,C39667095_decoy,WEE1,Decoy,0.0,-8.41508,-10.14,-3.75,-11.128439814610166
CC[C@@H](C(=O)N1C[C@@H](C(=O)NCCc2ccc(C)cc2C)C2(CC[NH2+]CC2)C1)c1ccccc1,C39667097_decoy,WEE1,Decoy,0.0,-8.26722,-9.87,-4.07,-8.007378465309927
CC[C@H](C(=O)N1C[C@@H](C(=O)NCCc2cc(C)ccc2C)C2(CC[NH2+]CC2)C1)c1ccccc1,C39677000_decoy,WEE1,Decoy,0.0,-8.07223,-10.97,-2.82,-7.95461323117907
CC[C@@H](C(=O)N1C[C@@H](C(=O)NCCc2cc(C)ccc2C)C2(CC[NH2+]CC2)C1)c1ccccc1,C39677001_decoy,WEE1,Decoy,0.0,-7.88334,-10.1,-2.58,-9.326892435910928
CCc1ccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)Cc3ccc(Cl)cc3)CC23CC[NH2+]CC3)cc1,C39696056_decoy,WEE1,Decoy,0.0,-8.46712,-9.66,-2.82,-7.003495267192994
CSc1ccc([C@H](Nc2cccc[nH+]2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)cc1,C38550646_decoy,WEE1,Decoy,0.0,-12.3604,-4.67,-2.21,-7.832827281523703
O=C(NCCc1cccc(C(F)(F)F)c1)[C@H]1C[NH2+]C[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1,C43223274_decoy,WEE1,Decoy,0.0,-7.86893,-8.96,-3.71,-7.165370062387134
CC[C@H](C)[C@@H]1[NH2+]C2(CCN(C(=S)Nc3ccc(F)cc3)CC2)N(Cc2ccc(F)cc2)C1=O,C36024324_decoy,WEE1,Decoy,0.0,-8.42999,-7.4,-2.52,-6.760763696874992
O=C1[C@@H](Cc2ccccc2)[NH2+]C2(CCN(C(=S)Nc3ccccc3F)CC2)N1Cc1ccccc1,C36026962_decoy,WEE1,Decoy,0.0,-9.049,-9.31,-2.67,-8.558197471422606
CC[C@H](C)[C@@H]1[NH2+]C2(CCN(C(=S)Nc3ccc(F)cc3)CC2)N(Cc2cccc(C(F)(F)F)c2)C1=O,C40399796_decoy,WEE1,Decoy,0.0,-7.7905,-7.25,-2.27,-6.830472966571758
CC(C)C[C@H]1[NH2+]C2(CCN(C(=S)Nc3ccc(F)cc3)CC2)N(Cc2ccccc2)C1=O,C36029066_decoy,WEE1,Decoy,0.0,-7.70437,-8.06,-2.48,-7.452447387136518
COc1ccc(NC(=S)N(Cc2ccccc2F)C2CC(C)(C)[NH2+]C(C)(C)C2)c(OC)c1,C59169011_decoy,WEE1,Decoy,0.0,-8.10082,-6.99,-1.86,-6.945680301437888
Cc1ccc(S(=O)(=O)N/[NH+]=c2\oc3ccccc3cc2C(=O)Nc2ccc(-c3ccccc3)cc2)cc1,C59170665_decoy,WEE1,Decoy,0.0,-9.77764,-9.78,-2.54,-11.725251391937295
COc1ccc(C2=C[C@@H](c3ccccc3F)N3NC=C(C(=O)Nc4ccc(C)cc4)C3=[NH+]2)cc1,C08597778_decoy,WEE1,Decoy,0.0,-7.42625,-10.6,-0.93,-9.238252187525122
COc1ccc([C@H](CN2CC[NH+](C)CC2)NC(=O)Nc2ccccc2SC2CCCC2)cc1,C60344421_decoy,WEE1,Decoy,0.0,-9.2004,-9.62,-1.71,-9.10692804348784
O=C(NCc1ccco1)C1=CC2=[NH+][C@H](c3ccc(Cl)c(Cl)c3)C[C@@H](C(F)(F)F)N2N1,C13124139_decoy,WEE1,Decoy,0.0,-9.46693,-8.43,-0.98,-8.462363187800587
O=C(N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)NCc1cccc(C(F)(F)F)c1)c1cccs1,C63234524_decoy,WEE1,Decoy,0.0,-9.16517,-9.8,-1.25,-8.822853134714121
C[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)Nc1cccc(Cl)c1,C39945691_decoy,WEE1,Decoy,0.0,-8.87723,-9.43,-2.87,-7.9533384615191025
C[C@@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)Nc1cccc(Cl)c1,C39945692_decoy,WEE1,Decoy,0.0,-9.92667,-8.79,-3.74,-8.21517555602592
OCCC/[NH+]=C/c1c(CSc2ccc(Cl)cc2)nn(-c2nc3ccccc3s2)c1O,C02268321_decoy,WEE1,Decoy,0.0,-12.0292,-7.22,-1.77,-9.380641243798776
Cc1cccc(N/C(=N\C(=O)c2ccc(Br)cc2)NCCC2=c3ccccc3=[NH+]C2)c1,C63588691_decoy,WEE1,Decoy,0.0,-8.97721,-10.55,-0.83,-10.535328640948524
CC(C)(C)c1ccc(CS[C@H]2Nc3ccccc3C(=O)N2NC(=O)CCC2=c3ccccc3=[NH+]C2)cc1,C63708503_decoy,WEE1,Decoy,0.0,-9.27673,-9.44,-2.16,-11.399920047687136
COc1ccc(OC)c([C@@H](Nc2cc(C)cc[nH+]2)c2cc(C)sc2NC(=O)c2ccco2)c1,C64790090_decoy,WEE1,Decoy,0.0,-9.06792,-5.7,-2.28,-6.701200945600709
O=C(Nc1cccc(S(=O)(=O)NC2=[NH+]CCC2)c1)[C@H](Sc1ccccc1)c1ccccc1,C09245847_decoy,WEE1,Decoy,0.0,-9.44585,-9.94,-1.0,-12.369825980765144
COCC/N=C1\S[C@@H](C(=O)c2ccc(OC(F)F)cc2)[C@H]([NH3+])C1c1nc2ccccc2s1,C09597127_decoy,WEE1,Decoy,0.0,-8.59165,-8.03,-1.91,-7.14835585886224
CN(C)S(=O)(=O)Nc1ccc(N2CCC([NH2+]C3c4ccccc4-c4ccccc43)CC2)cc1,C19853131_decoy,WEE1,Decoy,0.0,-8.32678,-8.73,-2.0,-7.006211880740414
COc1cc(C[NH2+]C2CCCC2)cc(Br)c1OC[C@@H](O)c1ccc2c(c1)OCCO2,C20877125_decoy,WEE1,Decoy,0.0,-9.78688,-8.52,-1.99,-8.209720749881312
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C[NH+]1CCc2sccc2[C@H]1c1cccs1,C22011600_decoy,WEE1,Decoy,0.0,-10.518,-8.17,-2.71,-9.0237470446946
O=C(C[NH+]1CCC[C@H](C(=O)Nc2ccccc2)C1)Nc1nc(-c2cc(F)ccc2F)cs1,C22242844_decoy,WEE1,Decoy,0.0,-9.08078,-5.34,-2.46,-5.581705547737252
C[C@H](C(=O)NC1CC1)[NH+]1CCN(CC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1,C22801116_decoy,WEE1,Decoy,0.0,-6.69629,-9.19,-4.74,-5.60031489519784
Cc1ccc(C)c(C[NH+]2CCN(c3nc(SCC(N)=O)nc4sc5c(c34)CCCC5)CC2)c1,C34756481_decoy,WEE1,Decoy,0.0,-11.8208,-9.73,-2.64,-9.993927971593624
CC[C@H](NC(=O)NC(C)(C)C)[C@H]1c2cc(OC)c(OC)cc2CC[NH+]1Cc1ccc(F)cc1,C36048484_decoy,WEE1,Decoy,0.0,-8.37957,-5.73,-1.17,-6.465058205096667
Cc1cc(Br)c(OCC(=O)NNC2=c3cc(F)ccc3=[NH+]C2=O)c(Br)c1,C01499308_decoy,WEE1,Decoy,0.0,-7.68105,-5.82,-1.11,-4.987101688239584
C[C@@H](CNC(=O)[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39595597_decoy,WEE1,Decoy,0.0,-8.3625,-9.5,-3.15,-8.297055968828609
C[C@H](CNC(=O)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39595692_decoy,WEE1,Decoy,0.0,-9.77163,-9.67,-1.84,-10.629206807949355
C[C@@H](CNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39595768_decoy,WEE1,Decoy,0.0,-9.91274,-8.49,-1.32,-8.834493940800229
Cc1ccc(CC(=O)N2C[C@@H](C(=O)NC[C@@H](C)Oc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)cc1,C39596545_decoy,WEE1,Decoy,0.0,-7.97471,-8.92,-3.63,-7.724354856103785
Cc1ccccc1CC(=O)N1C[C@H](C(=O)NC[C@H](C)Oc2ccc(F)cc2)C2(CC[NH2+]CC2)C1,C39596558_decoy,WEE1,Decoy,0.0,-7.81215,-9.6,-2.49,-7.810765981114424
Cc1cccc(CC(=O)N2C[C@H](C(=O)NC[C@@H](C)Oc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)c1,C39596563_decoy,WEE1,Decoy,0.0,-8.87799,-9.79,-3.62,-8.994667195426453
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)NCc3ccc(OC(F)(F)F)cc3)C3(CC[NH2+]CC3)C2)c1F,C39599736_decoy,WEE1,Decoy,0.0,-8.34501,-10.15,-3.15,-8.311320903916805
CC[C@@H](C)CNC(=O)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39606422_decoy,WEE1,Decoy,0.0,-8.48349,-5.36,-3.31,-6.384341999668196
O=C(N[C@@H]1CCC[C@H]1OCc1ccccc1)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39608931_decoy,WEE1,Decoy,0.0,-10.2686,-9.68,-3.12,-10.189406560352271
CCc1ccc(C(=O)N2C[C@@H](C(=O)N[C@@H]3CCC[C@H]3OCc3ccccc3)C3(CC[NH2+]CC3)C2)cc1,C39608935_decoy,WEE1,Decoy,0.0,-9.56704,-4.68,-3.85,-5.59158685177186
O=C(NCCCc1ccccc1)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39623718_decoy,WEE1,Decoy,0.0,-8.20003,-6.36,-2.37,-6.295769988756139
O=C(NC1CCCCCC1)[C@H]1CN(C(=O)c2cccnc2Oc2ccccc2)CC12CC[NH2+]CC2,C39633648_decoy,WEE1,Decoy,0.0,-8.05712,-9.62,-3.12,-8.746319829472265
COc1ccc(Br)c(C(=O)N2C[C@@H](C(=O)N[C@H]3CCCC[C@@H]3C)C3(CC[NH2+]CC3)C2)c1,C39636003_decoy,WEE1,Decoy,0.0,-8.84805,-6.26,-2.91,-5.014390916314023
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCCc2ccccc2F)C2(CC[NH2+]CC2)C1,C39639002_decoy,WEE1,Decoy,0.0,-8.70391,-10.7,-2.98,-9.355297354521667
CCOc1cccc(C(=O)N2C[C@@H](C(=O)N[C@H](C)c3ccc(Br)cc3)C3(CC[NH2+]CC3)C2)c1,C39657161_decoy,WEE1,Decoy,0.0,-9.59929,-7.58,-1.41,-8.955823738413292
C[C@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665121_decoy,WEE1,Decoy,0.0,-7.14575,-9.4,-2.38,-8.50574195383011
CC[C@H](C(=O)N1C[C@@H](C(=O)NC[C@@H](C)Oc2ccccc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39665262_decoy,WEE1,Decoy,0.0,-9.06152,-9.47,-3.44,-10.31024681562172
C[C@@H](CNC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2)Oc1ccccc1,C39665287_decoy,WEE1,Decoy,0.0,-9.16192,-8.85,-1.75,-9.669695735568157
C[C@H](CNC(=O)[C@H]1CN(C(=O)c2cc(Cl)ccc2F)CC12CC[NH2+]CC2)Oc1ccccc1,C39665289_decoy,WEE1,Decoy,0.0,-9.35178,-8.52,-1.75,-10.67651366855386
O=C(NCc1ccc(OC(F)F)cc1)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39673281_decoy,WEE1,Decoy,0.0,-7.96349,-8.61,-4.49,-5.5703008717177775
COc1cccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(Br)c(C)c3)CC23CC[NH2+]CC3)c1,C39676722_decoy,WEE1,Decoy,0.0,-8.54363,-9.63,-1.97,-8.455361719717308
Cc1ccc(C(=O)N2C[C@H](C(=O)NCc3ccccc3N3CCCCC3)C3(CC[NH2+]CC3)C2)cc1,C39678206_decoy,WEE1,Decoy,0.0,-8.69074,-10.61,-3.15,-8.782444680308696
O=C(NCc1ccccc1N1CCCCC1)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2,C39678242_decoy,WEE1,Decoy,0.0,-7.73679,-10.05,-2.02,-10.614333672669956
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCc3cccc(OC(F)F)c3)C3(CC[NH2+]CC3)C2)c(C)c1,C39678565_decoy,WEE1,Decoy,0.0,-8.93808,-10.59,-2.82,-9.98403601093324
Cc1cc(C(=O)N2C[C@H](C(=O)NCCOc3ccccc3F)C3(CC[NH2+]CC3)C2)ccc1Br,C39685111_decoy,WEE1,Decoy,0.0,-7.68107,-9.73,-3.03,-7.469035794310519
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(Br)cc2)CC12CC[NH2+]CC2,C39686515_decoy,WEE1,Decoy,0.0,-7.65374,-6.0,-1.67,-5.660471670539595
COc1ccccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(C)c(F)c2F)CC12CC[NH2+]CC2,C39686586_decoy,WEE1,Decoy,0.0,-7.70847,-7.36,-3.35,-6.221305476947733
C[C@H](Cc1ccccc1F)NC(=O)[C@H]1CN(C(=O)c2ccc3ccccc3n2)CC12CC[NH2+]CC2,C39687193_decoy,WEE1,Decoy,0.0,-9.09519,-9.06,-2.89,-7.412966652761086
CC[C@H](NC(=O)[C@@H]1CN(C(=O)[C@@H](Oc2ccccc2)C(C)C)CC12CC[NH2+]CC2)c1ccccc1,C39695388_decoy,WEE1,Decoy,0.0,-9.03071,-10.63,-2.92,-11.32681112680796
COC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)C[NH+]1C[C@]2(C)C[C@H]1CC(C)(C)C2,C40200672_decoy,WEE1,Decoy,0.0,-8.2229,-8.79,-1.88,-9.516811486693644
S=C(NC[C@H]1C[C@H]2CC[NH+]1C[C@@H]2CN1CCc2ccccc21)Nc1ccc(-n2cccn2)cc1,C43527597_decoy,WEE1,Decoy,0.0,-7.98817,-9.55,-3.36,-8.369185011796906
C=CCNC(=O)CN1CC[NH+]([C@H](C)C(=O)Nc2ccc(Br)cc2Br)CC1,C45606769_decoy,WEE1,Decoy,0.0,-8.65208,-6.82,-2.1,-7.746277247252499
CC[C@@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccc(C)cc21,C63376148_decoy,WEE1,Decoy,0.0,-9.20847,-6.2,-3.29,-5.3483170244382965
CC[C@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccc(C)cc21,C63376149_decoy,WEE1,Decoy,0.0,-8.3244,-6.19,-3.31,-4.899253647813324
C[C@H](NC(=O)[C@@H]1CC2=c3ccccc3=[NH+][C@H]2[C@@H]2c3ccccc3C(=O)N12)C(=O)NC1CCCCC1,C63376175_decoy,WEE1,Decoy,0.0,-8.0944,-11.39,-2.67,-11.07212859726107
CC[C@@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2c(C)cccc21,C63383858_decoy,WEE1,Decoy,0.0,-7.97942,-5.53,-1.55,-4.592384917058408
CC[C@@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2c(C)cccc21,C63383861_decoy,WEE1,Decoy,0.0,-8.98225,-6.35,-1.79,-5.346089857419829
CC[C@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccc(F)cc21,C63478293_decoy,WEE1,Decoy,0.0,-8.56758,-5.62,-2.93,-5.922582960404226
O=C(NCCC1=c2ccccc2=[NH+]C1)C(=O)NC[C@H](c1cccs1)N1CCc2ccccc2C1,C63706834_decoy,WEE1,Decoy,0.0,-9.39073,-8.65,-2.06,-7.863755623625411
COc1c(Br)cc(Cl)cc1S(=O)(=O)NNC(=O)C1=c2ccccc2=[NH+]C1,C64208421_decoy,WEE1,Decoy,0.0,-8.95099,-6.43,-2.08,-5.827566388590673
O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1ccc(Br)cc1,C02506497_decoy,WEE1,Decoy,0.0,-8.50425,-10.49,-0.95,-8.19389829405663
Cc1ccc2c(C)c(C(=O)Nc3sc4c(c3C(=O)N[C@H]3CCS(=O)(=O)C3)CC[C@@H](C)C4)oc2c1,C09209628_decoy,WEE1,Decoy,0.0,-9.63015,-11.51,-4.04,-10.796771772365656
COc1ccc([C@H]2Nn3c(C)nnc3S[C@H]2C(=O)Nc2cc(C)ccc2C)cc1Br,C09237785_decoy,WEE1,Decoy,0.0,-7.31422,-4.79,-3.26,-4.687372136739156
COc1ccc([C@H]2Nn3c(C)nnc3S[C@@H]2C(=O)Nc2cccc(C)c2C)cc1Br,C09237835_decoy,WEE1,Decoy,0.0,-8.41996,-6.15,-1.22,-6.7936968744494655
Cc1cccc(NC(=O)Nc2nc(C(=O)N3CCN(c4cccc(C(F)(F)F)c4)CC3)cs2)c1,C08979930_decoy,WEE1,Decoy,0.0,-9.8237,-8.68,-2.35,-7.522465147992503
CC(=O)N1c2ccc(S(=O)(=O)NCC3CCC(C(=O)Nc4ccc(C)cc4C)CC3)cc2C[C@H]1C,C09430609_decoy,WEE1,Decoy,0.0,-8.15817,-10.02,-4.11,-8.15198194611874
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)sc2c1CC[C@H](C)C2,C12064280_decoy,WEE1,Decoy,0.0,-8.63704,-10.25,-1.94,-8.657504097350344
CC(=O)Nc1ccc(NC(=O)[C@H](C)Sc2nc3sc4c(c3c(=O)n2C2CCCC2)CCCC4)cc1,C03220312_decoy,WEE1,Decoy,0.0,-8.07602,-9.25,-3.39,-8.393133671492233
C[C@@]12C=C[C@@]3(O1)[C@H](C(=O)N(c1ccccc1F)[C@@H]3C(=O)NC1CCCC1)[C@@H]2C(=O)Nc1ccccc1,C12642294_decoy,WEE1,Decoy,0.0,-8.63625,-4.85,-3.43,-5.220908394240454
C[C@H](NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)C1)c1ccccc1,C09406857_decoy,WEE1,Decoy,0.0,-8.38707,-11.16,-1.28,-10.770882287249693
Nc1cccc2c1C(=O)N(CC(=O)N1N=C3/C(=C/c4cccs4)CCC[C@H]3[C@H]1c1cccs1)C2=O,C12547053_decoy,WEE1,Decoy,0.0,-10.1089,-9.06,-4.6,-8.225364940404868
Cc1sc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)nc1-c1ccc(Br)cc1,C14911479_decoy,WEE1,Decoy,0.0,-8.55117,-8.51,-1.15,-10.15290860854791
O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1cc2c(s1)CCCCCC2,C15497709_decoy,WEE1,Decoy,0.0,-8.61413,-9.05,-4.37,-7.488923341082744
COc1ccc(NC(=O)c2cc(C)oc2C)cc1S(=O)(=O)Nc1cc(C)ccc1Br,C16179209_decoy,WEE1,Decoy,0.0,-8.98885,-8.82,-1.97,-13.949537187829296
Cc1ccccc1NC(=O)N1CCC[C@H]1C(=O)Nc1nnc(-c2ccc(Br)cc2)s1,C16572403_decoy,WEE1,Decoy,0.0,-8.20488,-5.61,-0.88,-4.761618512672924
C/C(=N\NC(=O)c1sc(NS(=O)(=O)c2ccccc2)nc1C)c1ccc(Br)cc1,C16887139_decoy,WEE1,Decoy,0.0,-9.30694,-8.88,-1.19,-9.298460506532102
Cc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)[C@@H]1C[C@H](O)CN1C(=O)C12CC3CC(CC(C3)C1)C2,C18461502_decoy,WEE1,Decoy,0.0,-8.67032,-9.93,-1.67,-10.301922002898738
Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)N(C4CCCCC4)[C@H](C(=O)NC4CCCCC4)[C@]34C=C[C@H]2O4)cc1,C20106914_decoy,WEE1,Decoy,0.0,-9.54263,-5.94,-3.49,-6.237698629074972
C[C@H](C(=O)N1CCN(C)CC1)[C@H]1CC[C@@]2(C)Cc3sc(NC(=O)CC(C)(C)C)nc3[C@@H](C)[C@@H]2[C@H]1O,C20504555_decoy,WEE1,Decoy,0.0,-8.35985,-5.5,-3.83,-5.477382451093505
Cc1nc2c(ccc3nc(NC(=O)c4cccc(NS(=O)(=O)c5ccc(F)cc5)c4)sc32)s1,C20570485_decoy,WEE1,Decoy,0.0,-9.80812,-9.83,-1.43,-9.345683542096754
CC1CCN(S(=O)(=O)c2cccc(C(=O)Nc3ccccc3C(=O)Nc3ccc(F)cc3)c2)CC1,C20755832_decoy,WEE1,Decoy,0.0,-8.70849,-5.7,-1.18,-5.349033750250663
CC(=O)Nc1c2n(c3sc(C)c(C)c13)C[C@](C)(C(=O)NC1CCCCCC1)N(C1CCCC1)C2=O,C21522700_decoy,WEE1,Decoy,0.0,-7.43928,-5.25,-2.45,-5.259589027773928
NS(=O)(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(c4ccc(Cl)cc4)N=C3C(F)(F)F)o2)cc1,C22288946_decoy,WEE1,Decoy,0.0,-9.06953,-10.08,-2.99,-7.906615868794085
CCC(=O)Nc1cccc(NC(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc(C)cc2)c1C,C23184529_decoy,WEE1,Decoy,0.0,-8.99197,-3.26,-3.55,-4.600385290098517
C[C@@H]1Oc2c(C(=O)Nc3ccc(NC(=O)c4cccc(S(C)(=O)=O)c4)c(Cl)c3)cccc2[C@H]1C,C25577882_decoy,WEE1,Decoy,0.0,-8.87996,-9.46,-1.86,-7.266250996663031
CCSc1sccc1[C@H]1C(C#N)=C(N)N(c2ccc(Cl)cc2[N+](=O)[O-])C2=C1C(=O)CCC2,C27550409_decoy,WEE1,Decoy,0.0,-6.40391,-5.9,-1.43,-4.329877232699369
CCSc1sccc1[C@@H]1C(C#N)=C(N)N(c2ccc([N+](=O)[O-])cc2Cl)C2=C1C(=O)CCC2,C27550437_decoy,WEE1,Decoy,0.0,-9.05238,-4.32,-0.83,-4.080544180270698
O=C(Nc1ccc(-c2cn3ccsc3n2)cc1)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1,C29794920_decoy,WEE1,Decoy,0.0,-8.99483,-8.9,-1.43,-13.495614632639334
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)C1,C29414042_decoy,WEE1,Decoy,0.0,-8.84244,-11.1,-2.33,-9.371331061488654
O=C(Nc1cccc2nsnc12)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1,C33170514_decoy,WEE1,Decoy,0.0,-9.52175,-10.03,-4.1,-9.58328172735366
CC(=O)Nc1c(C)noc1/C=C/c1ccc(S(=O)(=O)Nc2ccc(Br)c(C)c2)s1,C33306444_decoy,WEE1,Decoy,0.0,-10.0326,-8.71,-3.26,-8.651721748472056
Cc1ccc(-c2nnc(NC(=O)[C@@H]3CCCN3C(=O)Nc3cccc(Br)c3)s2)cc1,C33630820_decoy,WEE1,Decoy,0.0,-9.31366,-5.53,-1.78,-5.194257431516803
COc1ccc([C@@H]2[C@@H](C(=O)c3ccc(C)cc3)N3c4ccccc4C=C[C@@H]3[C@]2(C#N)C(N)=O)cc1OC,C33821876_decoy,WEE1,Decoy,0.0,-7.5127,-5.38,-4.28,-4.898961838474827
Cc1ccccc1NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(=O)C2CCCCC2)[C@H](C)C1,C34978311_decoy,WEE1,Decoy,0.0,-8.30188,-5.49,-3.94,-4.7963612445987485
CCCN1C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(C)c(C)c3)[C@H]3C=C[C@@]2(O3)[C@H]1C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C,C35394266_decoy,WEE1,Decoy,0.0,-9.03647,-7.3,-3.15,-6.547293489486072
Cc1ccc(NC(=O)N2CCC([C@@H](NC(=O)c3ccc(C)cc3)C(=O)N3CCCC[C@H]3C)CC2)cc1,C36213714_decoy,WEE1,Decoy,0.0,-9.11056,-7.33,-5.03,-4.954186620238618
C[C@@H]1CCc2c(sc3nc(-c4cccnc4)nc(N4CCN([C@H](C(N)=O)c5ccccc5)CC4)c23)C1,C14855608_decoy,WEE1,Decoy,0.0,-11.3062,-6.33,-1.21,-7.869948057048174
NN1[C@@H](SCC(=O)c2ccc(Br)cc2)N=N[C@H]1[C@@H]1C=C(c2ccc(Cl)cc2)N=N1,C38556372_decoy,WEE1,Decoy,0.0,-10.0465,-9.54,-3.1,-8.208186776816476
CC(=O)N1CC2=C(OC(N)=C(C#N)[C@@H]2c2ccccc2OC(C)C)/C(=C/c2ccccc2OC(C)C)C1,C39326702_decoy,WEE1,Decoy,0.0,-7.86313,-5.52,-1.64,-4.485974511569381
Cn1nc2nc(N3CCN(Cc4ccc(F)cc4)CC3)nc(-c3ccc(C(F)(F)F)cc3)c2c1N,C40386815_decoy,WEE1,Decoy,0.0,-8.61655,-9.83,-2.06,-7.921436263909941
O=C1[C@H]2[C@@H](C(=O)N1C1CCCCC1)[C@@](C(=O)[O-])(c1ccccc1)[NH2+][C@H]2c1cccc(OC(F)(F)F)c1,C43218817_decoy,WEE1,Decoy,0.0,-6.84711,-6.36,-1.56,-5.000235944277136
Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1,C46793249_decoy,WEE1,Decoy,0.0,-9.26852,-10.86,-2.02,-8.426682563280298
CC(C)(C)[C@H]1CCc2c(sc(N[C@H]3OC(=O)c4ccccc43)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C47136021_decoy,WEE1,Decoy,0.0,-9.66665,-9.95,-0.89,-12.914736250926538
CC(C)(C)[C@@H]1CCc2c(sc(N[C@H]3OC(=O)c4ccccc43)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C47136024_decoy,WEE1,Decoy,0.0,-9.92553,-8.31,-2.44,-8.205982231197465
CC1=C(C(=O)OCC(F)(F)C(F)(F)F)[C@@H](c2cc3c(cc2Br)OCO3)NC(=O)N1,C01508389_decoy,WEE1,Decoy,0.0,-7.27597,-8.7,-1.67,-7.799467241310417
O=C(N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1cccc(S(=O)(=O)N2CCCCCC2)c1,C25172389_decoy,WEE1,Decoy,0.0,-9.36441,-9.54,-2.61,-9.521863804328891
O=C(C[C@H]1C(=O)N(c2ccc(F)cc2)C(=S)N1NC(=O)c1ccc(Cl)cc1)Nc1ccccc1,C58941305_decoy,WEE1,Decoy,0.0,-8.30125,-8.6,-3.7,-7.767729601659315
O=C(NC(=S)Nc1ccc(N2CCN(C(=O)c3ccccc3)CC2)c(Cl)c1)c1cc2ccccc2o1,C59331746_decoy,WEE1,Decoy,0.0,-9.33263,-9.33,-3.99,-7.351789469870586
CC1=NN(C(=O)C2=CC3=[NH+][C@H](c4ccc(C)c(C)c4)C[C@H](C(F)(F)F)N3N2)[C@@]([O-])(C(F)(F)F)C1,C13958100_decoy,WEE1,Decoy,0.0,-7.02275,-6.25,-1.39,-5.159309111752361
Cc1ccc(-c2nc(C)sc2CC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCCCN3)cc2)cc1,C12533041_decoy,WEE1,Decoy,0.0,-9.62432,-9.47,-3.94,-8.35763364873116
CC(C)(C)c1ccc(-c2cn(C[C@H]3C[C@@H]4CC[NH+]3C[C@@H]4C(=O)NCc3ccc(F)cc3)nn2)cc1,C08299339_decoy,WEE1,Decoy,0.0,-10.0089,-8.28,-2.85,-7.820221748201583
O=C1C2=CN=C(c3ccc(Cl)cc3)S[C@@H]2C(=O)N1CCNc1[nH+]cc(C(F)(F)F)cc1Cl,C03047125_decoy,WEE1,Decoy,0.0,-11.2149,-9.53,-1.81,-8.372357214329899
CC(C)(C)C(=O)[C@@H]1[C@H](C(=O)c2ccccn2)[C@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C09088215_decoy,WEE1,Decoy,0.0,-8.16387,-4.66,-2.25,-5.320473048480372
CC(C)(C)C(=O)[C@@H]1[C@@H](C(=O)c2ccccn2)[C@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C09088216_decoy,WEE1,Decoy,0.0,-7.25217,-6.24,-2.15,-4.064542248737286
CN(C(=O)C[NH+]1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1C(=O)NCc1ccco1,C09155051_decoy,WEE1,Decoy,0.0,-10.0004,-7.67,-3.99,-8.131147358133735
O=C1CSc2ccc(C(=O)N3CC[NH+](C(c4ccc(F)cc4)c4ccc(F)cc4)CC3)cc2N1,C09252896_decoy,WEE1,Decoy,0.0,-9.73292,-8.22,-4.5,-8.969158521984037
C[C@@H](c1nnc(SCC(=O)Nc2c(F)c(F)c(F)c(F)c2F)n1-c1ccc(F)cc1)[NH+](C)C,C02625100_decoy,WEE1,Decoy,0.0,-7.64517,-8.36,-2.81,-7.301274405690602
COC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C12CC[NH+](Cc1ccc(C#CC(C)(C)O)cc1)CC2,C11969450_decoy,WEE1,Decoy,0.0,-10.6768,-6.16,-2.67,-6.982525155103525
Cc1sc(NC(=O)c2ccco2)c([C@H](c2ccc3c(c2)OCCO3)[NH+]2C[C@@H](C)C[C@H](C)C2)c1C,C12485518_decoy,WEE1,Decoy,0.0,-8.72825,-4.83,-2.0,-5.075388335154727
O=C(C[NH+]1CCc2sccc2[C@@H]1c1cccs1)Nc1ccc(S(=O)(=O)N2CCCC2)cc1,C12679102_decoy,WEE1,Decoy,0.0,-10.3961,-6.2,-2.65,-5.919014638446573
C[NH+]1CCN(C(=O)c2cccc3c2N[C@H](c2ccc(OCc4ccccc4)cc2)[C@H]2CC=C[C@H]32)CC1,C14470017_decoy,WEE1,Decoy,0.0,-10.3238,-9.86,-3.47,-8.556803267048904
O=C(c1ccco1)[C@@H]1[C@@H](C(=O)c2ccc(F)cc2)[C@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C16007103_decoy,WEE1,Decoy,0.0,-7.70482,-5.38,-3.69,-4.549583589413792
O=C(c1ccccc1)N1CC[NH+]([C@H]2c3cccc4cccc(c34)[C@H]2NS(=O)(=O)c2ccccc2)CC1,C08680756_decoy,WEE1,Decoy,0.0,-7.00906,-6.31,-4.4,-4.259587337662308
CC[NH+]1CCN(c2ccc(NC(=O)c3nn(-c4ccc(F)cc4)c4c3CCCCC4)c(C)c2)CC1,C22320295_decoy,WEE1,Decoy,0.0,-9.87638,-9.52,-0.71,-12.724227926239193
CC1CC[NH+]([C@H](CNC(=O)C2CCN(C(=O)c3ccc(F)cc3F)CC2)c2cccs2)CC1,C22681508_decoy,WEE1,Decoy,0.0,-9.41823,-8.14,-2.84,-7.8860200676116925
O=C(C[NH+]1CCN(C(=O)CN2CCSc3ccccc32)CC1)Nc1ccccc1C(F)(F)F,C23707280_decoy,WEE1,Decoy,0.0,-9.5902,-7.49,-3.35,-6.710888717741553
O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1,C24537987_decoy,WEE1,Decoy,0.0,-10.2892,-9.19,-3.88,-9.54949464771166
Cc1ccc([C@H](C)NC(=O)C2CC[NH+](Cc3nc(-c4cccc(Br)c4)no3)CC2)cc1,C30978802_decoy,WEE1,Decoy,0.0,-9.5601,-8.19,-1.87,-8.11173418000159
O=C(Nc1ccc(Br)cc1F)[C@@H]1CCC[NH+](Cc2nc(-c3ccc(Cl)cc3)no2)C1,C31045561_decoy,WEE1,Decoy,0.0,-8.79157,-9.37,-1.83,-8.803715062690696
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)CC2)c(C)c1,C32217780_decoy,WEE1,Decoy,0.0,-9.40679,-8.75,-3.24,-8.258977174402984
Cc1cccc(C(=O)N2CC[NH+](CC(=O)Nc3ccc(F)cc3)CC2)c1I,C33219318_decoy,WEE1,Decoy,0.0,-9.07261,-8.37,-3.19,-9.194341453622954
Cc1ccc(C(=O)N2CCC(CC(=O)NCCN3CC[NH+](c4cccc(C)c4C)CC3)CC2)cc1,C32974226_decoy,WEE1,Decoy,0.0,-8.80187,-8.82,-4.53,-6.885719640840064
CC(C)(C)c1ccc(C(=O)N2CC[NH+]([C@@H](C(=O)Nc3ccc(Cl)cc3)C3CCCC3)CC2)cc1,C36311222_decoy,WEE1,Decoy,0.0,-8.75523,-5.92,-3.79,-6.303103151411476
O=C(Nc1cccc(F)c1)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccccc2C(F)(F)F)CC1,C36311896_decoy,WEE1,Decoy,0.0,-8.42683,-7.94,-2.31,-7.579574910604851
CC(C)(C)c1ccc(C(=O)N2CC[NH+]([C@H](C(=O)Nc3ccc(F)cc3F)C3CCCC3)CC2)cc1,C36312028_decoy,WEE1,Decoy,0.0,-9.65807,-9.39,-3.79,-5.671477155775507
C[C@H](NC(=O)[C@@H]1COc2ccccc2O1)[C@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1,C38595784_decoy,WEE1,Decoy,0.0,-8.18732,-9.1,-1.42,-8.595600950857557
O=C(NC[C@@H](c1ccsc1)[NH+]1CCCCCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1,C38673735_decoy,WEE1,Decoy,0.0,-10.2478,-9.93,-2.24,-12.813775267076224
CN(CC(=O)Nc1ccccc1Br)[C@H](C(=O)C1=c2ccccc2=[NH+]C1)c1ccccc1,C38796911_decoy,WEE1,Decoy,0.0,-8.25654,-8.53,-2.73,-7.74668762039943
Oc1c(Br)cc(Br)cc1/C=N/N1C(=S)N=[NH+][C@@H]1c1ccccc1Cl,C38966169_decoy,WEE1,Decoy,0.0,-9.80946,-8.92,-1.03,-8.453467765807314
CC1(C)O[C@]2(CC[C@@H]3[C@H]4CC[C@H]5CCCC[C@]5(C)[C@H]4CC[C@@]32C)CN1C(=O)CSC1=[NH+]CCN1,C12402485_decoy,WEE1,Decoy,0.0,-8.31581,-8.12,-1.67,-7.720567223403544
COC(=O)[C@@H]1CC2=C3CC=CC=C3N=C2[C@H]2C[C@H]([NH2+]C3CC3)C[C@@H](c3ccc(C(F)(F)F)cc3)N21,C39560852_decoy,WEE1,Decoy,0.0,-7.9535,-5.84,-2.42,-5.378570724631166
O=C(/C=C/c1ccc(F)cc1)NC1CC[NH+](Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)CC1,C40961321_decoy,WEE1,Decoy,0.0,-8.30895,-9.72,-4.06,-8.760639431545654
Cc1nc(N2CCC[C@@H]([NH2+]CCC3=CC[C@@H]4C[C@H]3C4(C)C)CC2)nc2cc(S(C)(=O)=O)ccc12,C43641654_decoy,WEE1,Decoy,0.0,-8.97702,-8.07,-1.68,-6.586059401192648
CC1(C)O[C@@]2(CC[C@@H]3[C@H]4CC[C@@H]5CCCC[C@@]5(C)[C@H]4CC[C@]32C)CN1C(=O)CSC1=[NH+]CCN1,C43769775_decoy,WEE1,Decoy,0.0,-7.75112,-6.39,-1.34,-5.964312534675809
COc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)C1CC[NH+](Cc2ccc(Br)cc2)CC1,C44855680_decoy,WEE1,Decoy,0.0,-8.42978,-8.1,-3.42,-7.175866727330911
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCc3ccc(C[NH+]4CCC[C@H](C)C4)cc3)C2)s1,C46816578_decoy,WEE1,Decoy,0.0,-10.3443,-9.39,-2.06,-13.51096581085349
S=c1n(C[NH2+]C2(c3ccc(Br)cc3)CCOCC2)nc(-c2cccnc2)n1C1CC1,C48289567_decoy,WEE1,Decoy,0.0,-8.9536,-6.96,-2.2,-7.575616474815391
C[C@H](c1ccccc1)N1C(=O)[C@@H](C)[NH2+]C12CCN(S(=O)(=O)c1cccc(C(F)(F)F)c1)CC2,C36027162_decoy,WEE1,Decoy,0.0,-8.69485,-6.34,-1.62,-6.199547416610215
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccc(C[NH+]4CCC[C@@H](C)C4)cc3)CC2)cc1,C58948814_decoy,WEE1,Decoy,0.0,-9.29811,-9.62,-5.74,-5.271751098667412
C[C@H](NC1CC[NH+](Cc2ccc(Cl)cc2)CC1)C1=NC(=O)C2=C(c3cccs3)CSC2=N1,C39773872_decoy,WEE1,Decoy,0.0,-7.82915,-8.83,-3.24,-6.718446017913576
C[C@H]1CCN(C(=O)CS[C@H]2NN=C(C3=c4ccccc4=[NH+]C3)N2C2CC2)c2ccccc2S1,C39939553_decoy,WEE1,Decoy,0.0,-8.44619,-6.79,-1.93,-5.207815723069753
C[C@@H]1[NH+]=c2ccc(F)cc2=C1CCNC(=O)C1CCN(C(=O)c2ccccc2Br)CC1,C63280103_decoy,WEE1,Decoy,0.0,-8.43205,-9.72,-1.54,-7.682883152686792
C[C@H]1c2cc3c4c(oc3cc2OC(=O)[C@@H]1CC(=O)NCCC1=c2cc(F)ccc2=[NH+]C1)CCCC4,C63485961_decoy,WEE1,Decoy,0.0,-8.66404,-10.35,-1.63,-7.313625936399084
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1[C@H]2C(=O)N(c3cccc(C(F)(F)F)c3)C[C@]23C=C[C@H]1O3,C63491465_decoy,WEE1,Decoy,0.0,-7.8382,-11.12,-2.5,-8.079778765961212
Cc1ccc(CN2c3ccsc3C(=O)/C(=C/NCCC3=c4ccccc4=[NH+]C3)S2(=O)=O)cc1,C63584608_decoy,WEE1,Decoy,0.0,-8.8363,-9.82,-1.4,-11.026208254822212
Oc1c(Br)cc(Br)cc1/C=N/N1C(=S)[NH+]=N[C@@H]1c1ccc(Cl)cc1,C39011980_decoy,WEE1,Decoy,0.0,-10.3522,-5.9,-2.25,-5.42548606345733
COc1ccc([C@H]2c3cccn3-c3sc4c(c3CN2C(=O)Nc2cccc(C)c2)CC[NH+](C)C4)cc1,C35426984_decoy,WEE1,Decoy,0.0,-8.51851,-5.44,-1.65,-5.330392911911395
COc1ccccc1NC(=O)N1Cc2c(sc3c2CC[NH+](C)C3)-n2cccc2[C@H]1c1ccc(Cl)cc1,C35427206_decoy,WEE1,Decoy,0.0,-6.17504,-4.89,-1.67,-3.5676453259991847
C[NH+]1CCN(c2nn3c(NC4CCCCCC4)c(-c4ccc(Br)cc4)nc3s2)CC1,C64746094_decoy,WEE1,Decoy,0.0,-9.69231,-8.98,-0.09,-7.432531790585729
C[C@H](C(=O)NCCC1=c2cc(Cl)ccc2=[NH+]C1)C1CCN(S(=O)(=O)c2cccs2)CC1,C65061852_decoy,WEE1,Decoy,0.0,-10.6633,-8.71,-3.68,-8.807345190793676
Cc1ccc(C(=O)[C@@H]2[C@H]3CCC[NH+]3[C@@]3(C(=O)Nc4c(C)cc(C)cc43)[C@]23C(=O)Nc2ccccc23)cc1,C08971869_decoy,WEE1,Decoy,0.0,-7.93834,-5.64,-2.27,-4.521859095190981
COC(=O)c1c(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)sc2c1CC(C)(C)[NH2+]C2(C)C,C09505395_decoy,WEE1,Decoy,0.0,-9.90457,-8.56,-2.85,-10.754955995322796
CN(C1CC1)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC(C)(C)[NH2+]C3(C)C)cc1,C10099571_decoy,WEE1,Decoy,0.0,-11.0119,-10.16,-1.82,-15.311660733519318
O=C(C[NH+]1CCN(c2nc(-c3ccc(F)cc3)cs2)CC1)NNC(=O)c1ccc(Br)cc1,C12877626_decoy,WEE1,Decoy,0.0,-8.60259,-7.91,-3.6,-6.340568483700772
C[C@@H](NC(=O)C[NH+]1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1)c1ccc2c(c1)CCCC2,C12993062_decoy,WEE1,Decoy,0.0,-8.08817,-10.96,-3.89,-8.332713200891304
COc1ccc(Br)cc1C(=O)NC(=S)Nc1ccc(N2CC[NH+](C)CC2)cc1,C06287956_decoy,WEE1,Decoy,0.0,-10.2292,-8.05,-1.63,-8.474191198885277
[NH2+]=C(N/N=C/c1ccc(Br)cc1)S[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1=O,C13302273_decoy,WEE1,Decoy,0.0,-9.24385,-7.93,-3.98,-7.738000307065926
O=C(C[C@H]1C(=O)NCCN1C(=O)C[NH+]1CCN(c2ccc(Cl)cc2)CC1)Nc1ccc(F)cc1,C20676672_decoy,WEE1,Decoy,0.0,-8.78369,-8.84,-3.64,-7.8661418379676595
NC(=O)[C@@H]1Cc2ccccc2C[NH+]1CC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1,C14672882_decoy,WEE1,Decoy,0.0,-8.33553,-9.55,-1.67,-8.04912687629493
CCN1C([NH-])=CC(=C2N=C(c3ccc(F)cc3)/C(=[NH+]/C(C)=O)S2)c2c1[nH+]c1c(C)cccn1c2=O,C26841482_decoy,WEE1,Decoy,0.0,-8.17491,-5.08,-1.34,-4.181673531408138
C[C@H]1CCCC[C@H]1NC(=O)NC(=O)C[NH+]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1,C32811617_decoy,WEE1,Decoy,0.0,-8.67998,-9.1,-3.23,-7.454565163309597
C[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2ccc(OC(=O)c4ccc5c(c4)OCO5)cc2)N3)C1,C36093611_decoy,WEE1,Decoy,0.0,-9.90866,-10.34,-1.63,-6.847403315339897
CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@H](NC(=O)[C@@H]1CCC[NH2+]C1)C2,C34001986_decoy,WEE1,Decoy,0.0,-9.8725,-5.63,-2.89,-6.082972692546577
COC(=O)[C@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)C(O)(c1ccccc1)c1ccccc1,C38653685_decoy,WEE1,Decoy,0.0,-9.0729,-6.06,-1.0,-6.368972609786409
CSC1=C[C@H]2C[NH+]3N[P@@](=O)(c4ccccc4O)OC[C@@H]3C[C@@H]2C=C1S(=O)(=O)Oc1ccccc1,C39467574_decoy,WEE1,Decoy,0.0,-9.36474,-6.19,-2.51,-5.619250088013874
O=[P@@]1(S(=O)(=O)Oc2ccccc2)N[NH+]2C[C@@H]3C=C(O)C(Cc4ccccc4)=C[C@@H]3C[C@H]2CO1,C39469600_decoy,WEE1,Decoy,0.0,-7.7384,-6.43,-2.49,-4.780775988045692
C[C@@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39595362_decoy,WEE1,Decoy,0.0,-9.13366,-6.32,-2.39,-6.779939011728488
O=C(NC1CCCCCC1)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39633445_decoy,WEE1,Decoy,0.0,-8.07762,-7.36,-1.43,-6.0526139115557225
O=C(NC1CCCCCC1)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39633759_decoy,WEE1,Decoy,0.0,-8.7625,-7.71,-2.76,-6.58821494106778
Cc1ccc(Oc2ncccc2C(=O)N2C[C@H](C(=O)N[C@H]3CCCC[C@@H]3C)C3(CC[NH2+]CC3)C2)cc1,C39636040_decoy,WEE1,Decoy,0.0,-9.78154,-7.69,-3.12,-7.88420762707594
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@H]3CCCC[C@@H]3C)C3(CC[NH2+]CC3)C2)cc1Cl,C39636103_decoy,WEE1,Decoy,0.0,-10.4401,-8.4,-3.02,-8.665853852730892
C[C@H]1[C@@H](NC(=O)[C@@H]2CN(C(=O)c3ccc(Oc4ccccc4)nc3)CC23CC[NH2+]CC3)CCC[C@@H]1C,C39637454_decoy,WEE1,Decoy,0.0,-9.2676,-6.31,-2.5,-5.1555976864821815
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)N[C@H]2CCC[C@@H](C)[C@H]2C)C2(CC[NH2+]CC2)C1,C39637501_decoy,WEE1,Decoy,0.0,-9.4277,-6.6,-5.28,-5.331783183980146
Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)c3cc(Cl)ccc3F)CC23CC[NH2+]CC3)cc1,C39666170_decoy,WEE1,Decoy,0.0,-9.44955,-8.85,-3.45,-8.98366159283978
Cc1ccc(O[C@H](C)CNC(=O)[C@@H]2CN(C(=O)c3csc4ccccc34)CC23CC[NH2+]CC3)cc1,C39666225_decoy,WEE1,Decoy,0.0,-9.20966,-8.66,-2.03,-13.60073673499474
Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)cc1,C39666234_decoy,WEE1,Decoy,0.0,-7.94499,-9.64,-2.37,-6.189191345160062
O=C(NCc1cccc(OC(F)F)c1)[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2,C39678404_decoy,WEE1,Decoy,0.0,-9.01499,-9.2,-1.29,-10.206966452387718
Cc1ccc(Oc2ncccc2C(=O)N2C[C@@H](C(=O)N[C@@H](C)C(C)(C)C)C3(CC[NH2+]CC3)C2)cc1,C39684600_decoy,WEE1,Decoy,0.0,-8.40404,-9.65,-1.99,-9.139117475153178
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)N[C@H](C)C(C)(C)C)C3(CC[NH2+]CC3)C2)cc1Cl,C39684666_decoy,WEE1,Decoy,0.0,-10.7155,-7.56,-3.16,-9.42943390689705
COc1ccccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc3ccccc3c2)CC12CC[NH2+]CC2,C39686437_decoy,WEE1,Decoy,0.0,-7.12558,-6.65,-2.57,-5.8425616883121085
CCc1ccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3csc(Cl)c3OC)CC23CC[NH2+]CC3)cc1,C39696196_decoy,WEE1,Decoy,0.0,-10.352,-7.69,-2.55,-8.864316794468326
Cc1ccccc1N1C(=O)c2ccccc2N[C@H]1SCC(=O)N/N=C/C1=c2ccccc2=[NH+]C1,C39923297_decoy,WEE1,Decoy,0.0,-8.08944,-10.14,-1.59,-8.37957731320842
CCCCNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@@H]([C@H](C)C(=O)N3CCN(C)CC3)[C@H](O)[C@H]1[C@@H]2C,C43548614_decoy,WEE1,Decoy,0.0,-8.36147,-5.34,-3.27,-5.875522300171204
COC(=O)[C@H](CC(C)C)NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(Br)cc1F,C44577211_decoy,WEE1,Decoy,0.0,-8.98654,-4.91,-1.11,-4.820049475924524
[NH3+][C@@H](CC(=O)N1CCC[C@H]1c1nc(-c2ncc(F)cc2F)no1)Cc1cc(F)c(F)cc1F,C45245131_decoy,WEE1,Decoy,0.0,-9.03648,-9.17,-1.78,-8.955927120444624
CC[C@H]1Nc2c(C)cc(C)[nH+]c2N1Cc1ccc2c(c1)CCN2[C@@H](c1ccccc1)c1nnn[nH]1,C52607219_decoy,WEE1,Decoy,0.0,-9.08177,-11.02,-2.85,-11.310613712089548
COc1c(C)c[nH+]c(CN2CC[NH+]([C@H](C(=O)[O-])c3c[nH]c4cc(Br)ccc34)CC2)c1C,C31807884_decoy,WEE1,Decoy,0.0,-7.88202,-7.75,-2.24,-8.346919142778646
COc1c(C)c[nH+]c(CN2CC[NH+]([C@@H](C(=O)[O-])c3c[nH]c4cc(Br)ccc34)CC2)c1C,C31807880_decoy,WEE1,Decoy,0.0,-9.37475,-9.41,-2.46,-9.269761259419631
O=C(CCNC(=O)c1ccc(Br)cc1)Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1,C59588681_decoy,WEE1,Decoy,0.0,-9.15923,-9.53,-1.53,-7.725807303566623
COc1ccccc1NC(=O)C1=CC2=[NH+][C@H](c3ccc4c(c3)OCO4)C[C@@H](C(F)(F)F)N2N1,C12467935_decoy,WEE1,Decoy,0.0,-8.43198,-8.5,-2.48,-9.309705276201344
COc1ccc([C@@H]2C[C@H](C(F)(F)F)N3NC(C(=O)Nc4ccc5c(c4)OCO5)=CC3=[NH+]2)cc1,C12468861_decoy,WEE1,Decoy,0.0,-8.8822,-8.81,-1.94,-7.325690741280026
O=C(CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)Nc1ccc2c(c1)OC1(CCCCC1)O2,C39938594_decoy,WEE1,Decoy,0.0,-10.2476,-9.52,-1.42,-8.004941092262737
O=C(CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)Nc1ccc2c(c1)OC1(CCCCC1)O2,C39938595_decoy,WEE1,Decoy,0.0,-8.90034,-10.28,-1.79,-8.407541214731726
CC(=O)Nc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@H]2Nc2cccc(Cl)c2)cc1,C39977540_decoy,WEE1,Decoy,0.0,-9.34236,-10.14,-2.48,-8.741809656877258
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1c1ccccc1,C63384544_decoy,WEE1,Decoy,0.0,-9.36161,-5.98,-2.3,-5.419413436441507
CC(C)(C)N1C(=O)[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C63478579_decoy,WEE1,Decoy,0.0,-9.7328,-6.04,-1.67,-5.640660455554739
O=C(NCCC1=c2ccccc2=[NH+]C1)c1ccc(NC(=O)N2CCSc3ncccc32)cc1,C63573607_decoy,WEE1,Decoy,0.0,-6.79854,-10.19,-4.44,-7.330518897479823
CC(=O)Nc1ccc(N[C@H]2[NH+]=c3ccccc3=N/C2=N\S(=O)(=O)c2cc(C)ccc2C)cc1,C38966347_decoy,WEE1,Decoy,0.0,-8.47455,-5.58,-2.92,-4.948948324754934
Cc1ccc(C)c(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2cc(F)cc(F)c2)c1,C65074748_decoy,WEE1,Decoy,0.0,-8.01178,-5.16,-2.99,-5.390557020662601
Cc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccc(F)c(Cl)c2)cc1C,C65074822_decoy,WEE1,Decoy,0.0,-9.63335,-5.59,-3.62,-5.842534877150007
CCOC(=O)c1c(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2)sc2c1CC[C@@H](C)C2,C04259838_decoy,WEE1,Decoy,0.0,-10.0466,-8.11,-1.58,-9.01091623900576
O=C(N/N=C/c1cc(Br)ccc1OC(=O)c1ccccc1)C(=O)Nc1ccccc1,C02544093_decoy,WEE1,Decoy,0.0,-7.71941,-6.28,-0.78,-5.710808819357069
COc1cccc(OC)c1C(=O)NC(=S)Nc1ccc(-c2nc3cc(C)cc(C)c3o2)cc1,C04123007_decoy,WEE1,Decoy,0.0,-9.36694,-7.46,-4.36,-7.031852676500368
CCOC(=O)C1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1ccc(OC)c(COc2ccc(C)cc2)c1,C01003086_decoy,WEE1,Decoy,0.0,-8.9605,-5.47,-3.39,-5.646799358611853
Cc1ccc(Nc2nnc(SCC(=O)Nc3cc(S(C)(=O)=O)ccc3Cl)s2)c(C)c1,C08724004_decoy,WEE1,Decoy,0.0,-9.15381,-8.95,-1.64,-10.656921958804457
COc1cccc(/C=N/Nc2nc(-c3ccccc3)c(NC(=O)c3cccs3)s2)c1OC,C08867629_decoy,WEE1,Decoy,0.0,-9.8983,-8.42,-2.09,-11.954138618038288
COc1ccc(C(C)(C)C)cc1NC(=O)CNc1cccc(S(=O)(=O)N2CCCCC2)c1,C09121155_decoy,WEE1,Decoy,0.0,-8.00093,-8.44,-2.97,-7.832864220894569
C[C@@H](CCc1ccccc1)NC(=O)CN1C(=O)CN(C(=O)NCc2ccccc2)c2ccccc21,C09588477_decoy,WEE1,Decoy,0.0,-7.12517,-9.46,-3.02,-9.659442511240652
Cc1ccc(C(=O)OCC(=O)Nc2ccc(Br)cc2F)cc1NC(=O)c1ccco1,C09632962_decoy,WEE1,Decoy,0.0,-9.05702,-9.0,-2.86,-10.553991633373926
C=CCn1c(SCC(=O)NC(=O)N[C@@H]2CCCC[C@H]2C)nnc1-c1ccc(Cl)cc1,C10240361_decoy,WEE1,Decoy,0.0,-9.86321,-8.32,-1.45,-9.192131816152152
COc1ccc(NC(=O)c2ccc(NC(=O)COC(=O)C34CC5CC(CC(C5)C3)C4)cc2)cc1,C10800983_decoy,WEE1,Decoy,0.0,-8.92168,-8.78,-3.01,-7.253499057012495
Cc1c(C#N)c(NC(=O)CSc2nnc(CCC3CCCC3)[nH]2)n(-c2cccc(F)c2)c1C,C12105025_decoy,WEE1,Decoy,0.0,-9.31565,-8.35,-3.31,-8.246688962923194
C=CCN(C(=O)CSc1nnc(-c2ccccc2F)n1N)c1nc(-c2ccccc2)cs1,C09684902_decoy,WEE1,Decoy,0.0,-8.10428,-7.86,-1.04,-7.69001711040092
COc1ccc(C(=O)NC(=S)Nc2ccc3oc(-c4cc(C)cc(C)c4)nc3c2)cc1OC,C14270862_decoy,WEE1,Decoy,0.0,-10.6191,-8.51,-0.99,-9.31499402452962
O=C(CCc1nc(-c2ccc(F)cc2)no1)NNC(=O)c1ccc(-c2ccc(F)cc2)s1,C15091334_decoy,WEE1,Decoy,0.0,-9.3282,-6.35,-2.5,-6.188734526571826
COc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1c(NC(=O)C(C)(C)C)sc(C)c1C,C17133584_decoy,WEE1,Decoy,0.0,-8.24173,-8.61,-3.17,-7.898669311412908
CCOC(=O)C1=C(CN2CCN(c3cccc(C)c3C)CC2)NC(=O)N[C@H]1c1ccc(Cl)cc1,C12412546_decoy,WEE1,Decoy,0.0,-7.31004,-8.08,-4.26,-6.862469028427582
CCOC(=O)C1=C(CN2CCN(c3ccc(C)cc3C)CC2)NC(=O)N[C@H]1c1ccc(C)cc1,C20560238_decoy,WEE1,Decoy,0.0,-8.42748,-8.38,-3.26,-5.217657433912022
COc1cccc(C/[NH+]=C(\Nc2cccc(C(=O)[O-])c2)N2CCN(c3ccc(F)cc3)CC2)c1,C21096623_decoy,WEE1,Decoy,0.0,-9.5906,-6.04,-3.23,-4.798464570015045
CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)C1=O,C21237098_decoy,WEE1,Decoy,0.0,-7.23025,-9.01,-2.86,-6.570441977017466
C[C@@H](OC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1)C(=O)N[C@@H]1CCCC[C@@H]1C,C21348695_decoy,WEE1,Decoy,0.0,-7.94594,-9.19,-2.91,-7.435169075923124
COc1ccc(CCN2C(=S)SC(C)(C)[C@@H]2N(O)C(=O)NC2CCCCC2)cc1OC,C22002279_decoy,WEE1,Decoy,0.0,-8.54607,-7.01,-5.11,-6.941859073658176
C[C@H](Sc1nnc(COc2ccc(C(C)(C)C)cc2)n1N)C(=O)N1c2ccccc2C[C@H]1C,C22534971_decoy,WEE1,Decoy,0.0,-10.6868,-8.36,-3.25,-8.901827900925275
Cc1cc(C)c(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c(C)c1,C26326641_decoy,WEE1,Decoy,0.0,-7.08062,-7.23,-1.72,-6.421240873338208
CCOC(=O)C1=C(CN2CCCc3cc(F)cc(F)c32)NC(=O)N[C@@H]1c1ccc(OC)cc1,C26726177_decoy,WEE1,Decoy,0.0,-9.53909,-9.07,-2.12,-13.92645847831214
CC(=O)Nc1ccc(NC(=O)c2ccccc2Sc2nccnc2Oc2ccccc2)cc1,C33289247_decoy,WEE1,Decoy,0.0,-9.492,-8.47,-3.81,-11.130990734023998
CCC(=O)Nc1c(C)noc1/C=C\c1ccc(S(=O)(=O)Nc2cccc(SC)c2)cc1,C33297924_decoy,WEE1,Decoy,0.0,-9.03279,-8.85,-1.54,-8.45415214169848
COc1ccc(NC(=O)[C@@H]2CC[C@H](c3ccccc3)N(C(=O)NCc3ccccc3)C2)cc1OC,C34733137_decoy,WEE1,Decoy,0.0,-8.89482,-6.5,-3.5,-5.966887337671428
Cc1ccc(-n2c(SCc3ccccc3)nnc2[C@H](C)NC(=O)Nc2cccc(C#N)c2)cc1,C35226237_decoy,WEE1,Decoy,0.0,-8.46291,-7.3,-3.17,-6.664901701823127
CC[C@@H](NC(=O)c1ccc(Cl)cc1)[C@H]1c2cc(OC)c(OC)cc2CCN1C(=O)NC(C)C,C35674641_decoy,WEE1,Decoy,0.0,-8.87381,-5.38,-3.6,-4.954863556458905
CCCNC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1[C@H](CC)NC(=O)c1ccc(C)cc1,C35674681_decoy,WEE1,Decoy,0.0,-9.05475,-5.14,-4.4,-5.639750829123263
C[C@@H](Sc1nnc(Cc2cccs2)n1C1CCCCC1)C(=O)NC(=O)Nc1ccccc1,C11979692_decoy,WEE1,Decoy,0.0,-7.90665,-8.22,-3.57,-6.803719781153787
CCOC(=O)C1=C(CN2CCN(c3cc(C)ccc3C)CC2)NC(=O)N[C@@H]1c1ccc(Cl)cc1,C20214186_decoy,WEE1,Decoy,0.0,-10.0151,-8.01,-1.77,-8.242317611630652
COc1ccc(OC)c([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(Cl)cc4)ccc32)c1,C38659974_decoy,WEE1,Decoy,0.0,-9.18944,-10.13,-2.86,-8.249484930795912
COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C/c4ccc(C)cc4)ccc32)cc1,C38683349_decoy,WEE1,Decoy,0.0,-7.43806,-9.6,-3.08,-6.923869043222735
CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4)ccc32)c1,C38684900_decoy,WEE1,Decoy,0.0,-9.31778,-9.05,-1.26,-14.630649014220714
CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C)cc4)ccc32)cc1,C38685688_decoy,WEE1,Decoy,0.0,-8.65991,-8.74,-1.41,-7.715886959549956
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)OC(=O)c1c(NC(=O)C2CCCCC2)sc2c1CCC2,C10933298_decoy,WEE1,Decoy,0.0,-10.2645,-9.15,-0.8,-10.798890785015102
CC(C)COc1ccc(S(=O)(=O)NCC2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc1,C43962371_decoy,WEE1,Decoy,0.0,-7.92057,-8.92,-4.13,-7.8388064735963745
C[C@@H]1CN(S(=O)(=O)c2ccc(NC(=O)CNc3ccc(C(C)(C)C)cc3)cc2)C[C@@H](C)O1,C57523957_decoy,WEE1,Decoy,0.0,-7.90804,-6.81,-4.15,-5.755210269927806
COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccc(Br)cc3)cc2)cc1OC,C58900646_decoy,WEE1,Decoy,0.0,-8.36812,-8.33,-2.42,-6.814617407303439
CCCC(=O)Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2)cc1,C59344917_decoy,WEE1,Decoy,0.0,-8.26161,-9.32,-1.3,-7.536575851535873
O=C(CSc1ccc(/C=N/NS(=O)(=O)c2ccc3ccccc3c2)o1)Nc1ccccc1,C59387284_decoy,WEE1,Decoy,0.0,-10.4687,-10.95,-3.97,-9.699871935269265
Cc1cc(/C=N/NC(=O)C(=O)Nc2ccc(Oc3ccccc3)cc2)c(C)n1-c1ccccc1,C59566518_decoy,WEE1,Decoy,0.0,-8.93674,-6.92,-2.07,-5.673480644616374
COC(=O)c1ccc2nc(NC(=S)NC(=O)c3ccc(OC)c(Br)c3)sc2c1,C20412438_decoy,WEE1,Decoy,0.0,-9.00662,-8.79,-0.56,-7.925834372556964
CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)c1,C59768902_decoy,WEE1,Decoy,0.0,-9.75519,-9.78,-1.53,-9.026029642967892
CC(=O)NC1(c2noc(CCC(=O)NC3(c4ccc(Cl)cc4)CCCC3)n2)CCCCCC1,C60351506_decoy,WEE1,Decoy,0.0,-10.03,-7.82,-2.03,-8.15035605784025
CCCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2sc3c(c2C#N)CCCCC3)C1=O,C60386545_decoy,WEE1,Decoy,0.0,-9.10003,-7.61,-2.11,-7.205269859672038
COc1cccc(CSc2nnc(-c3sc4ncccc4c3N)n2Cc2ccco2)c1,C64794457_decoy,WEE1,Decoy,0.0,-7.72247,-5.57,-2.3,-4.971509163242772
C[C@H](Oc1ccccc1C(C)(C)C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1,C64982849_decoy,WEE1,Decoy,0.0,-8.41996,-8.69,-3.99,-10.05040191181076
COc1ccc(C(=O)Nc2nc3c(s2)C[C@]2(C)CC[C@@H]([C@H](C)C(=O)N4CC[NH+](C)CC4)[C@H](O)[C@H]2[C@@H]3C)cc1,C04222001_decoy,WEE1,Decoy,0.0,-9.26004,-8.78,-2.55,-7.723564955355718
Nc1cn2nc(N3CC[NH+](C(c4ccccc4)c4ccccc4)CC3)nc2nc1S(=O)(=O)c1ccccc1,C04395344_decoy,WEE1,Decoy,0.0,-9.53626,-9.24,-1.5,-10.406417194975354
O=c1[nH]c(=O)n(Cc2ccco2)c2c1C(C(F)(F)F)(C(F)(F)F)[NH+]=C(CCC1CCCCC1)N2,C09312009_decoy,WEE1,Decoy,0.0,-8.14859,-8.39,-0.31,-8.573702913172275
CCOC(=O)c1c(NC(=O)CSc2nncn2-c2ccccc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C03618389_decoy,WEE1,Decoy,0.0,-9.68233,-8.15,-0.85,-11.134078001252655
Cc1ccc(C(=O)NNC(=O)CSc2nnc([C@H](C)[NH+]3CCCCC3)n2-c2ccc(F)cc2)cc1,C09396240_decoy,WEE1,Decoy,0.0,-8.65843,-9.72,-1.59,-8.291518340421392
C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[NH+](C)CC(=O)N1CCC(C(=O)Nc2ccccc2)CC1,C11345015_decoy,WEE1,Decoy,0.0,-7.41129,-8.68,-4.82,-5.9269523302234495
CCOC(=O)[C@H]1CCCN(c2[nH+]c(-c3cc4ccccc4s3)ccc2C(=O)N2CCC(C(N)=O)CC2)C1,C11910771_decoy,WEE1,Decoy,0.0,-8.72607,-9.73,-2.86,-7.507235806876631
[NH2+]=C(NS(=O)(=O)c1cc(Cl)c(Oc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1)c1ccncc1,C01040679_decoy,WEE1,Decoy,0.0,-8.54846,-9.82,-2.68,-8.113450747186
C/C(=C\c1ccccc1)CNc1cc(C(=O)N2CCC[NH+](C)CC2)cc(S(=O)(=O)NC(C)(C)C)c1,C14745803_decoy,WEE1,Decoy,0.0,-10.1561,-8.05,-2.69,-8.192044033565617
CCOC(=O)c1c(NC(=O)CSc2nnnn2C2CCCC2)sc2c1CC(C)(C)[NH2+]C2(C)C,C16372383_decoy,WEE1,Decoy,0.0,-10.0809,-8.53,-0.14,-20.45806263659174
COC(=O)c1c(NC(=O)C[NH+](C)CC(=O)Nc2ccccc2Br)sc2c1CCCC2,C16633604_decoy,WEE1,Decoy,0.0,-8.93422,-7.47,-1.33,-7.375877085524072
O=C(C[C@H]1C(=O)NCCN1C(=O)C[NH+]1CCN(c2ccccc2F)CC1)Nc1cccc(C(F)(F)F)c1,C19818669_decoy,WEE1,Decoy,0.0,-9.26644,-10.37,-3.17,-9.664502406751632
O=C(C[C@@H]1C(=O)NCCN1C(=O)C[NH+]1CCN(c2ccccc2F)CC1)Nc1cccc(C(F)(F)F)c1,C19818670_decoy,WEE1,Decoy,0.0,-8.00912,-11.05,-1.48,-9.900923223549936
COc1ccc(N2CC[NH+](CC(=O)N3CCNC(=O)[C@@H]3CC(=O)Nc3cc(C)cc(C)c3)CC2)cc1,C19820964_decoy,WEE1,Decoy,0.0,-7.7098,-8.96,-2.58,-7.718979880803465
COc1ccc(N2CC[NH+](CC(=O)N3CCNC(=O)[C@@H]3CC(=O)Nc3ccc(C)cc3C)CC2)cc1,C19961973_decoy,WEE1,Decoy,0.0,-8.71235,-7.59,-2.87,-6.48548865085275
COc1ccc(N2CC[NH+](CC(=O)N3CCNC(=O)[C@H]3CC(=O)Nc3ccc(C(C)C)cc3)CC2)cc1,C20803063_decoy,WEE1,Decoy,0.0,-8.76306,-10.11,-3.24,-9.496788686799936
COC(=O)c1c(NC(=O)CN2CC[NH+](CC(=O)Nc3ccc(F)cc3)CC2)sc2c1CCCC2,C20811438_decoy,WEE1,Decoy,0.0,-10.267,-10.22,-2.65,-9.717134995181278
Cc1ccc(-c2noc(C[NH+]3CCC(C(=O)Nc4ccccc4C(=O)N[C@@H](C)c4ccccc4)CC3)n2)cc1,C30975788_decoy,WEE1,Decoy,0.0,-8.21188,-8.28,-4.76,-6.385760537769192
C[C@@H](NC(=O)c1ccccc1NC(=O)C1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1)c1ccccc1,C30982584_decoy,WEE1,Decoy,0.0,-8.51459,-8.82,-3.75,-7.31435528384219
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(CC)C(=O)N[C@@H]1c1ccc(F)cc1,C35992899_decoy,WEE1,Decoy,0.0,-8.11943,-4.73,-3.5,-5.394761976880042
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(CC)C(=O)N[C@@H]1c1ccc(C)cc1,C36013988_decoy,WEE1,Decoy,0.0,-8.55735,-5.2,-4.04,-5.166249238838298
O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc(N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)[nH+]c1,C34667795_decoy,WEE1,Decoy,0.0,-8.45508,-7.25,-2.74,-5.383326853370757
CCC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(C)c4ccccc4)cc3)c2C(=O)NC)C1,C08920701_decoy,WEE1,Decoy,0.0,-10.6496,-9.61,-1.48,-9.24658124192989
CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3nc(NC4CCCC4)c4ccccc4[nH+]3)CC2)cc1,C06553425_decoy,WEE1,Decoy,0.0,-10.3785,-8.88,-2.85,-7.485037703385785
COc1ccc2nc(NC(=O)C3=CC4=[NH+][C@H](c5ccc6c(c5)OCO6)C[C@@H](C(F)(F)F)N4N3)sc2c1,C01326746_decoy,WEE1,Decoy,0.0,-9.41877,-9.7,-4.49,-8.15357585236525
COc1ccc(Cl)cc1NC(=O)C(=O)NC[C@@H](c1ccco1)[NH+]1CCN(c2ccc(F)cc2)CC1,C38597985_decoy,WEE1,Decoy,0.0,-10.0759,-8.23,-2.79,-8.801145190297287
CCOC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(C)C3CC3)cc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C38850137_decoy,WEE1,Decoy,0.0,-11.3064,-9.9,-1.75,-10.290679680325823
C[C@H](NC(=O)c1ccccc1NC(=O)[C@H]1CCC[NH+](Cc2nc(-c3ccc(F)cc3)no2)C1)c1ccccc1,C38893986_decoy,WEE1,Decoy,0.0,-8.66655,-8.12,-1.66,-7.794395839720638
CC(C)NC(=O)c1ccccc1NC(=O)[C@@H]1CCC[NH+](Cc2nc(-c3ccc(C(C)(C)C)cc3)no2)C1,C38902596_decoy,WEE1,Decoy,0.0,-8.12013,-10.13,-2.59,-7.652741591219944
N#C[C@@H]1C2=C(CCC2)S[C@@H]1NC(=O)CS[C@H]1N=NC(N/N=C/c2cccc(Br)c2)=[NH+]1,C39403940_decoy,WEE1,Decoy,0.0,-8.76427,-7.36,-1.29,-7.638540894640664
C[C@@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)N[C@@H]2CCC[C@H]2OCc2ccccc2)C2(CC[NH2+]CC2)C1,C39608998_decoy,WEE1,Decoy,0.0,-9.28777,-10.56,-3.47,-12.315860741179742
COc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3ccc(Br)cc3)C3(CC[NH2+]CC3)C2)c(OC)c1,C39656886_decoy,WEE1,Decoy,0.0,-8.80583,-8.75,-1.44,-9.448933888131544
COc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)Cc3ccc(Cl)cc3)CC23CC[NH2+]CC3)cc1,C39665663_decoy,WEE1,Decoy,0.0,-7.93183,-8.94,-4.79,-7.819840551823643
COc1ccc(C(=O)N2C[C@@H](C(=O)NC[C@@H](C)Oc3ccc(C)cc3)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C39666173_decoy,WEE1,Decoy,0.0,-8.00879,-9.31,-4.05,-8.021420033553914
Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccc(-c4ccccc4)o3)CC23CC[NH2+]CC3)cc1,C39666247_decoy,WEE1,Decoy,0.0,-10.3441,-8.84,-4.43,-8.904072196099388
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3cc(C)nn3C(C)(C)C)CC23CC[NH2+]CC3)cc1,C39675413_decoy,WEE1,Decoy,0.0,-9.54366,-5.98,-2.52,-6.876309754970369
CC[C@@H](C)C(=O)N1C[C@@H](C(=O)NC(c2ccc(OC)cc2)c2ccc(OC)cc2)C2(CC[NH2+]CC2)C1,C39676560_decoy,WEE1,Decoy,0.0,-8.72624,-9.45,-1.98,-8.830854021364694
COc1cccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3cccnc3Oc3ccc(C)cc3)CC23CC[NH2+]CC3)c1,C39676774_decoy,WEE1,Decoy,0.0,-8.84437,-10.04,-3.02,-9.30904395691855
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCc2ccccc2N2CCCCC2)C2(CC[NH2+]CC2)C1,C39678375_decoy,WEE1,Decoy,0.0,-9.46847,-10.66,-3.99,-10.112666795633764
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCc2cccc(-n3cccc3)c2)C2(CC[NH2+]CC2)C1,C39694201_decoy,WEE1,Decoy,0.0,-9.26839,-10.9,-4.0,-13.385098858760104
CCCC1=C2[C@@H](c3ccc(OC)c(C[NH+]4CCN(c5ccc(F)cc5)CC4)c3)C(C#N)=C(N)O[C@@H]2N=N1,C39934001_decoy,WEE1,Decoy,0.0,-9.89716,-8.35,-2.06,-8.171334041635859
CCCc1nc(-c2ccc(N3CCC[C@H](C(=O)N4CCC(C(N)=O)([NH+]5CCCCC5)CC4)C3)c(F)c2)no1,C40876413_decoy,WEE1,Decoy,0.0,-8.83607,-7.52,-2.96,-6.921792977836547
COc1ccc([C@H](Nc2cccc[nH+]2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)cc1OC,C38550658_decoy,WEE1,Decoy,0.0,-9.53782,-5.39,-3.53,-6.262447513731275
Nc1nc(N2CCCc3ccccc32)nc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)[nH+]1,C19891133_decoy,WEE1,Decoy,0.0,-11.1356,-9.2,-2.89,-8.669300822090419
COc1ccc(OC)c(NC(=O)C2=CC3=[NH+][C@@H](c4ccc5c(c4)OCO5)C[C@@H](C(F)(F)F)N3N2)c1,C12465906_decoy,WEE1,Decoy,0.0,-8.2045,-10.37,-3.27,-8.080286777499902
COc1cc(NC(=O)CCNC(=O)N2CCC3=c4cc(Cl)ccc4=[NH+][C@@H]3C2)cc(OC)c1OC,C63315907_decoy,WEE1,Decoy,0.0,-9.22837,-8.54,-3.89,-8.85860333296567
Cc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3)CC1=O)C[NH+]=2,C63393535_decoy,WEE1,Decoy,0.0,-9.52828,-7.78,-1.76,-11.09280025197742
COc1cc2c(c(OC)c1OC)-c1ccc(NCCC3=c4ccccc4=[NH+]C3)c(=O)cc1[C@H](NC(C)=O)CC2,C63625931_decoy,WEE1,Decoy,0.0,-9.075,-7.51,-1.11,-7.529454628045087
COc1ccc2c(c1)=[NH+][C@H](Nc1cccc(NC(C)=O)c1)/C(=N/S(=O)(=O)c1ccc(Cl)cc1)N=2,C39006685_decoy,WEE1,Decoy,0.0,-9.47853,-6.06,-0.55,-5.882034537113453
CC(C)(C)OC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)Oc1ccc2c(c1)C(=O)N1CCC[C@H]1N2,C64416857_decoy,WEE1,Decoy,0.0,-9.3958,-9.73,-3.44,-8.765918291359212
Cc1cccc(C(=O)NC(Nc2nc3ccc(S(C)(=O)=O)cc3s2)(C(F)(F)F)C(F)(F)F)c1,C02050335_decoy,WEE1,Decoy,0.0,-7.45509,-9.35,-3.78,-8.563874281263738
Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cc3coc4cc(C)ccc34)cc2)cc1,C02636033_decoy,WEE1,Decoy,0.0,-8.67265,-9.96,-2.19,-7.790459371721578
CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1,C03423478_decoy,WEE1,Decoy,0.0,-9.47643,-9.66,-1.4,-8.931408812043683
COc1ccc(/C=c2\sc3n(c2=O)C(N)=C(C#N)[C@H](c2ccc(OC)cc2)C=3C(=O)OC(C)C)cc1,C00989129_decoy,WEE1,Decoy,0.0,-7.79342,-5.58,-1.45,-5.939101255774211
CCOC(=O)C1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1cc(Br)cc(Br)c1OC,C00639216_decoy,WEE1,Decoy,0.0,-7.72287,-5.0,-2.12,-4.088121014374137
CC(C)OC(=O)C1=C(CSc2nc3c(cc2C#N)CCCCC3)OC(N)=C(C#N)[C@@H]1c1ccncc1,C08451187_decoy,WEE1,Decoy,0.0,-8.36352,-9.31,-0.68,-8.329091614328732
CC(=O)Nc1ccc(NS(=O)(=O)c2cc(N(C)S(=O)(=O)c3ccc(C)cc3)c(C)cc2C)cc1,C08754498_decoy,WEE1,Decoy,0.0,-6.97298,-9.78,-3.39,-10.030809428675784
Cc1cc(C)cc(NC(=O)CSc2nnc(NC(=O)[C@@H]3CC(=O)N(c4ccc(C)c(C)c4)C3)s2)c1,C08909050_decoy,WEE1,Decoy,0.0,-9.92319,-8.33,-2.83,-6.5670577150855465
Cc1ccc(N2C[C@H](C(=O)Nc3nnc(SCC(=O)Nc4ccc(F)cc4F)s3)CC2=O)cc1C,C08909065_decoy,WEE1,Decoy,0.0,-9.1232,-9.74,-1.38,-7.392428415555904
O=C(CSc1nnc(CNC(=O)c2cccs2)n1-c1ccccc1)Nc1nc2ccccc2s1,C09369086_decoy,WEE1,Decoy,0.0,-10.1582,-5.34,-2.79,-6.134233226323777
O=C(NC(=S)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccc(S(=O)(=O)N2CCCC2)cc1,C09404669_decoy,WEE1,Decoy,0.0,-10.4234,-9.97,-2.26,-13.316314683093095
O=C(Nc1sc2c(c1C(=O)N[C@@H]1CCS(=O)(=O)C1)CCCC2)c1sc2ccccc2c1Cl,C09427854_decoy,WEE1,Decoy,0.0,-10.0317,-5.19,-2.2,-6.217368055600205
Cc1ccc(C(=O)N[C@H](C)c2nnc(SCC(=O)Nc3nc(-c4ccc(C)cc4)cs3)n2C)cc1,C09601196_decoy,WEE1,Decoy,0.0,-9.79709,-7.77,-3.48,-8.038775419069607
CCn1c(SCC(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)nnc1-c1ccc(C)cc1,C01474310_decoy,WEE1,Decoy,0.0,-10.1725,-8.75,-0.87,-9.92030626907689
O=C(CNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)N/N=C/c1ccc(Br)cc1,C11667585_decoy,WEE1,Decoy,0.0,-8.71686,-9.69,-4.85,-9.043280445028149
CC(/C=C1\SC(=S)N(CC(=O)NNC(=O)c2ccc(Br)cc2)C1=O)=C\c1ccccc1,C12278503_decoy,WEE1,Decoy,0.0,-8.90405,-7.62,-3.51,-7.897522380105869
Cc1ccc(NC(=S)N(Cc2ccc3c(c2)OCO3)Cc2cc3cc4c(cc3[nH]c2=O)OCO4)cc1,C06245303_decoy,WEE1,Decoy,0.0,-9.98518,-9.19,-3.34,-8.62411545916465
CC(C)(C)c1ccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1Br,C12500479_decoy,WEE1,Decoy,0.0,-9.82924,-7.87,-2.72,-7.237888007775112
CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccc(S(=O)(=O)N4CCCCCC4)cc3)n2)cc1,C12616555_decoy,WEE1,Decoy,0.0,-9.9064,-7.57,-2.87,-8.070255724312679
CC[C@@H](C)NC(=O)c1ccccc1NC(=O)[C@H]1CN(S(=O)(=O)Cc2ccccc2)c2ccccc2O1,C13679774_decoy,WEE1,Decoy,0.0,-9.65608,-8.83,-4.0,-8.793082950806424
Cc1cc(C(=O)N(NC(=O)C(O)(c2ccccc2)c2ccccc2)[C@H](c2ccccc2)c2ccco2)cs1,C02208082_decoy,WEE1,Decoy,0.0,-7.66699,-4.98,-2.48,-5.893861750653851
CCOC(=O)C1=c2s/c(=C/c3ccc(SC)cc3)c(=O)n2C(N)=C(C#N)[C@@H]1c1ccc(SC)cc1,C13739591_decoy,WEE1,Decoy,0.0,-7.93923,-5.08,-1.59,-5.2457207607868375
CC(C)NC(=O)c1ccc([C@@H]2Nc3ccccc3S(=O)(=O)N2Cc2cccc(C(F)(F)F)c2)cc1,C15868402_decoy,WEE1,Decoy,0.0,-8.81593,-5.73,-3.92,-5.841873406897334
COc1cccc(NC(=O)[C@@H]2[C@H]3C(=O)N(Cc4cccs4)[C@H](C(=O)NC4CCCCC4)[C@]34C=C[C@H]2O4)c1,C20106298_decoy,WEE1,Decoy,0.0,-10.4802,-9.05,-3.58,-9.03696138259566
O=C(COC(=O)C1C[C@H]2CCC[C@@H](C1)C21SCCS1)NNC(=O)c1ccc(Br)cc1,C13028199_decoy,WEE1,Decoy,0.0,-8.5937,-9.51,-3.03,-7.388428748176147
O=C(NC(=S)Nc1ccc(N2CCN(C(=O)/C=C/c3ccccc3)CC2)cc1)c1ccc(Cl)cc1,C30830808_decoy,WEE1,Decoy,0.0,-7.81256,-9.38,-2.22,-6.172583533790818
O=C(NO)C1CCC(CN(Cc2cccc(Br)c2)S(=O)(=O)c2ccc(Cl)cc2)CC1,C20665324_decoy,WEE1,Decoy,0.0,-10.0165,-9.14,-2.54,-10.111399041613138
NC(=O)CN1O[C@@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]2[C@@H]1c1ccc(-c2ccc(Br)cc2)o1,C33633865_decoy,WEE1,Decoy,0.0,-8.80182,-9.6,-1.53,-8.292705301557538
O=C(NCCNC(=O)C1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1)c1ccccc1,C34899896_decoy,WEE1,Decoy,0.0,-8.08434,-8.39,-2.86,-6.693193130509697
C/C=C(/C)C(=O)O[C@H]1[C@H](O)[C@H](C)O[C@H](O[C@]2(C)CC[C@H](O)[C@@]3(C)CC=C(C(C)C)C[C@@H]32)[C@@H]1OC(C)=O,C35271286_decoy,WEE1,Decoy,0.0,-6.43317,-5.51,-2.6,-4.352602585134201
Cc1ccc(C(=O)N[C@H](C(=O)N2CCCC[C@@H]2C)C2CCN(C(=S)Nc3ccc(F)cc3)CC2)cc1,C35749677_decoy,WEE1,Decoy,0.0,-7.72716,-9.28,-3.1,-7.411448654731394
CCOC(=O)C1=C(C)NC2=C(C(=O)[C@H](C(=O)OC)[C@H](C)C2)[C@@H]1c1cc(Br)c(O)c(OC)c1,C03631462_decoy,WEE1,Decoy,0.0,-9.0616,-9.21,-2.62,-11.112494827057091
COc1cc(OC)cc(C(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCCC[C@H]3NC(=O)c3ccccc3C)C2)c1,C35955604_decoy,WEE1,Decoy,0.0,-8.30588,-8.31,-2.49,-5.284518894136679
Cc1ccc(C(=O)Nc2cccc([C@H]3OC(=O)N(Cc4ccc(F)cc4)[C@@H]3C(=O)NCC3CC3)c2)cc1,C36218191_decoy,WEE1,Decoy,0.0,-8.4563,-6.63,-2.74,-5.901605416547721
COc1cc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(SC)cc2)cc(OC)c1OC,C38682321_decoy,WEE1,Decoy,0.0,-9.5741,-9.36,-2.59,-8.919801950139558
O=C(CC(=O)N/N=C/c1ccc(F)c(Br)c1)N/N=C/c1ccc(F)c(Br)c1,C20435660_decoy,WEE1,Decoy,0.0,-8.43832,-7.83,-3.47,-7.310656157591427
C[C@@H]1CCc2c(sc(NC(=O)c3ccc(Cl)cc3Cl)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C39836223_decoy,WEE1,Decoy,0.0,-10.7365,-9.76,-2.56,-10.524822780741024
O=C(Cc1coc2ccc(Br)cc12)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2,C39883305_decoy,WEE1,Decoy,0.0,-9.75526,-8.46,-0.73,-9.616373799401472
N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2,C39992580_decoy,WEE1,Decoy,0.0,-10.8877,-9.52,-2.43,-12.901686862337325
O=C(Nc1sc2c(c1C(=O)NC[C@H]1CCCO1)CCCC2)c1ccc(S(=O)(=O)c2ccccc2)o1,C40321281_decoy,WEE1,Decoy,0.0,-10.863,-10.34,-0.86,-17.41949378577639
CCCS(=O)(=O)c1ccc(-c2cc(C(=O)Nc3sc4c(c3C(=O)NCC)CCCC4)no2)cc1,C40325221_decoy,WEE1,Decoy,0.0,-9.05412,-9.39,-2.36,-8.840650273071278
O=C(NCc1ccccc1)c1c(NC(=O)[C@@H]2CC(=O)N(CCc3ccccc3)C2)sc2c1CCCC2,C40325717_decoy,WEE1,Decoy,0.0,-10.0298,-7.96,-3.73,-8.644895656071244
CC(C)[C@@H](C)NC(=O)[C@@H](NC(=O)c1ccccc1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1,C36214722_decoy,WEE1,Decoy,0.0,-8.86591,-8.42,-4.36,-8.10022299513538
CC(C)[C@H](C)NC(=O)[C@H](NC(=O)c1cccs1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1,C36214784_decoy,WEE1,Decoy,0.0,-10.4266,-8.92,-4.16,-8.730959749514316
CC(=O)NC[C@H](C)C[C@@H]1C(=O)C(C)=C2[C@]3(C)CC[C@H]4[C@H](CC=C5C[C@@H](OC(C)=O)CC[C@]54C)[C@@H]3C[C@@]21O,C43736407_decoy,WEE1,Decoy,0.0,-7.91095,-6.06,-2.69,-4.079172007049238
O=C(Cc1ccccc1)N[C@H](NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl,C43751617_decoy,WEE1,Decoy,0.0,-8.09173,-8.12,-2.9,-7.753238838756071
O=C(C[C@H](NS(=O)(=O)c1ccc(Br)cc1)c1ccccc1)Nc1ccccc1[N+](=O)[O-],C54201083_decoy,WEE1,Decoy,0.0,-8.24973,-5.66,-3.61,-5.380457731848141
CCNC(=O)C[C@H]1C(=O)N(c2ccc(OC)cc2)C(=S)N1NC(=O)c1ccc(Br)cc1,C33766598_decoy,WEE1,Decoy,0.0,-8.41136,-5.68,-2.56,-6.01617189340178
Cc1cc(C)c(NC(=O)c2ccccc2NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)c(C)c1,C35166836_decoy,WEE1,Decoy,0.0,-7.52781,-9.15,-2.36,-6.98856791953808
COc1ccc(C(=O)NC(=S)Nc2ccc3nn(-c4ccc(Br)cc4)nc3c2)cc1OC,C59437832_decoy,WEE1,Decoy,0.0,-10.4,-8.85,-1.33,-8.5779286359639
COc1ccc([C@H]2Oc3ccc(Br)cc3[C@@H]3CC(c4ccccn4)=NN23)c(C(=O)[O-])c1OC,C01252105_decoy,WEE1,Decoy,0.0,-7.78928,-9.3,-1.91,-7.266527610673212
O=C([O-])c1cccc(-n2nnc(S(=O)(=O)c3ccc(F)cc3)c2-c2ccc(Br)cc2)c1,C11730600_decoy,WEE1,Decoy,0.0,-7.61774,-6.09,-3.03,-4.568838932772774
Cc1c(C)c(C)c(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)CC2)c(C)c1C,C13073008_decoy,WEE1,Decoy,0.0,-8.92944,-8.76,-3.89,-8.196114843539009
CC(C)c1ccccc1-n1c(SCC(=O)N2CCC[C@@H](C(=O)[O-])C2)nnc1-c1ccc(Cl)cc1,C13412629_decoy,WEE1,Decoy,0.0,-8.23332,-6.89,-3.83,-5.931758960425366
CC(C)C1=C[C@@]23CC[C@@H]4[C@](C)(CCC[C@@]4(C)C(=O)[O-])[C@@H]2C[C@@H]1[C@H]1C(=O)N(c2ccccc2[N+](=O)[O-])C(=O)[C@H]13,C13540445_decoy,WEE1,Decoy,0.0,-6.74723,-5.3,-2.81,-4.813621554505441
CCCOC(=O)C1C(C)=NC2=C(C(=O)C[C@H](c3cccs3)C2)[C@H]1c1cc(OC)c([O-])c([N+](=O)[O-])c1,C15277227_decoy,WEE1,Decoy,0.0,-8.26737,-4.42,-2.32,-5.34728416993237
O=C1/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)C([O-])=NC(=S)N1c1cccc(Br)c1,C17045028_decoy,WEE1,Decoy,0.0,-8.14891,-9.03,-3.62,-9.688115849202816
COc1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2nc3ccc(F)cc3s2)cc1OC,C09271661_decoy,WEE1,Decoy,0.0,-8.6984,-5.77,-4.78,-5.231817074284061
O=C(C1=C([O-])C(=O)N(c2nc3ccc(F)cc3s2)[C@@H]1c1cccc(Br)c1)c1ccco1,C09043240_decoy,WEE1,Decoy,0.0,-8.89958,-5.46,-3.54,-5.650120553703619
COc1ccc([C@H]2C(C(=O)c3ccccc3)=C([O-])C(=O)N2c2nc3c(C)cc(C)cc3s2)cc1OC,C08898650_decoy,WEE1,Decoy,0.0,-7.83383,-5.81,-4.83,-5.259176711172673
C[C@H]1Cc2cc(C(=O)C3=C([O-])C(=O)N(c4nc5ccc(F)cc5s4)[C@@H]3c3ccccc3F)ccc2O1,C09357947_decoy,WEE1,Decoy,0.0,-8.61812,-5.82,-4.2,-4.921776951393122
COc1cccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2c2nc3ccc(F)cc3s2)c1,C09320603_decoy,WEE1,Decoy,0.0,-8.27341,-8.86,-1.33,-6.706324240349503
O=C(c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1)N1CCN(c2nc3ccc(F)cc3s2)CC1,C20571924_decoy,WEE1,Decoy,0.0,-8.83159,-9.54,-4.98,-7.43884889992952
C[C@@H]1CCc2cc(F)ccc2N1S(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)cc1,C20572300_decoy,WEE1,Decoy,0.0,-6.78277,-8.32,-3.81,-4.947280719713104
Cc1ccc2nc(N3C(=O)C([O-])=C(C(=O)c4ccncc4)[C@@H]3c3ccc(Br)cc3)sc2c1,C33599952_decoy,WEE1,Decoy,0.0,-9.24,-9.52,-2.15,-11.4332135971289
COc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2c2nc3ccc(F)cc3s2)cc1,C33723599_decoy,WEE1,Decoy,0.0,-8.90227,-6.11,-2.74,-6.385788137801827
COc1cccc(C(=O)C2=C([O-])C(=O)N(c3nc4ccc(F)cc4s3)[C@H]2c2cccc([N+](=O)[O-])c2)c1,C33795936_decoy,WEE1,Decoy,0.0,-8.48737,-6.07,-1.14,-5.70131597670724
COc1ccc([C@H]2C(C(=O)c3cccs3)=C([O-])C(=O)N2c2nc3ccc(Cl)cc3s2)cc1OC,C34920468_decoy,WEE1,Decoy,0.0,-12.0866,-5.34,-2.85,-5.890294249482438
COc1ccc([C@H]2C(C(=O)c3ccc(C)o3)=C([O-])C(=O)N2c2nc3ccc(Cl)cc3s2)cc1OC,C34921062_decoy,WEE1,Decoy,0.0,-8.47242,-5.05,-2.87,-5.50929445268397
CC[C@@H]1Oc2ccc([N-]S(=O)(=O)c3ccccc3C#N)cc2CN(CCc2ccccc2OC)C1=O,C35548090_decoy,WEE1,Decoy,0.0,-8.82617,-10.65,-1.93,-11.703205664108586
COC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3sc(C)nc3C)[C@H]2c2ccc(C(C)C)cc2)nc1C,C35565779_decoy,WEE1,Decoy,0.0,-9.24601,-5.49,-4.45,-5.053200057824953
O=C(c1ccc(Cl)cc1)c1cc(Br)ccc1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2,C35684227_decoy,WEE1,Decoy,0.0,-8.79047,-9.91,-2.08,-8.692493084181494
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N3CCN(C(C)=O)CC3)N2[C@@H]1c1ccccc1F,C36058670_decoy,WEE1,Decoy,0.0,-8.32838,-4.44,-2.42,-5.124056304500513
O=S(=O)(c1cccc(Cl)c1)N1CCC[C@@H](c2nc([O-])c3nnn(Cc4ccc(F)cc4)c3n2)C1,C06161896_decoy,WEE1,Decoy,0.0,-8.86844,-10.21,-2.65,-9.939463940753402
Cc1ccc([C@H]2C(C(=O)c3ccc4c(c3)OCCO4)=C([O-])C(=O)N2c2nc3c(C)cc(C)cc3s2)cc1,C09463383_decoy,WEE1,Decoy,0.0,-9.5706,-6.31,-3.86,-5.286815050935732
CC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3ccc4c(c3)OCCO4)[C@@H]2c2ccc(C(C)C)cc2)nc1C,C09425251_decoy,WEE1,Decoy,0.0,-8.92632,-7.47,-2.43,-6.966278724745405
COc1ccc([C@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2c2nc3ccc(F)cc3s2)cc1,C09124401_decoy,WEE1,Decoy,0.0,-8.03649,-6.18,-3.38,-5.491088411070382
CCOC(=O)c1sc(N2C(=O)C([O-])=C(C(=O)c3c(C)nc4ccccn34)[C@@H]2c2ccc(F)cc2)nc1C,C33813830_decoy,WEE1,Decoy,0.0,-7.82083,-8.25,-2.1,-6.679303501516312
COC(=O)c1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2nc3ccc(C)cc3s2)cc1,C00702394_decoy,WEE1,Decoy,0.0,-8.53584,-6.13,-3.52,-5.481927057898642
Cc1ccc(C(=O)C2=C([O-])C(=O)N(c3nnc(SCc4ccccc4)s3)[C@@H]2c2ccccc2)cc1,C39835139_decoy,WEE1,Decoy,0.0,-9.26495,-9.21,-3.32,-9.664552499503806
CCCSc1nnc(/N=C([O-])/C(C#N)=C/c2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)s1,C39998036_decoy,WEE1,Decoy,0.0,-9.66109,-8.86,-2.97,-8.392036102902669
Cc1ccc2nc(N3C(=O)C([O-])=C(C(=O)c4c(C)nc5c(C)cccn45)[C@H]3c3ccc(F)cc3)sc2c1,C40003429_decoy,WEE1,Decoy,0.0,-8.40276,-6.19,-1.48,-4.283981341267404
CCN(C(=O)c1oc2c(c1C)/C(=N/N=C(\[O-])C(F)(F)C(F)(F)C(F)(F)F)CCC2)c1cccc(C)c1,C40823293_decoy,WEE1,Decoy,0.0,-7.17697,-9.16,-2.91,-6.804302821098215
CSc1nc2ccc([N-]S(=O)(=O)c3ccc(-n4ncc(Cl)c(Cl)c4=O)cc3)cc2s1,C45526868_decoy,WEE1,Decoy,0.0,-10.5154,-9.18,-2.17,-9.044890907911412
O=C1[C@@H]2[C@@H](c3ccccc3OCc3ccccc3)c3sc([O-])nc3S[C@@H]2C(=O)N1c1ccc(F)cc1,C47147459_decoy,WEE1,Decoy,0.0,-9.26144,-5.6,-1.73,-5.577756280092571
Cc1ccc(S(=O)(=O)N2CCc3ccc([N-]S(=O)(=O)c4ccc(C(F)(F)F)cc4)cc3C2)cc1,C49511368_decoy,WEE1,Decoy,0.0,-8.75973,-10.82,-3.64,-11.170850480640178
COc1cc(C2C3=C(CC(C)(C)CC3=O)OC3=C2C(=O)CC(C)(C)C3)c(Br)cc1OCC(=O)[O-],C00886031_decoy,WEE1,Decoy,0.0,-8.64953,-4.42,-6.67,-3.829420421312838
Cc1c(/C=N/c2c(Br)cc([N+](=O)[O-])cc2Br)c([O-])n(CC(C)C)c(=O)c1C#N,C39894534_decoy,WEE1,Decoy,0.0,-7.73516,-7.74,-1.58,-6.528640402905356
Cc1ccc(COc2ccc(/C=C3/C(=O)N(c4ccc(F)cc4)C(=O)N=C3[O-])cc2Br)cc1,C59135137_decoy,WEE1,Decoy,0.0,-9.01855,-10.66,-0.52,-9.279437682397663
CCOc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2[O-])ccc1OCc1ccc2c(c1)OCO2,C59135278_decoy,WEE1,Decoy,0.0,-8.98218,-9.85,-0.67,-8.961907234484624
C=CCOc1ccc(/C=C2/C(=O)N(c3cccc(Br)c3)C(=O)N=C2[O-])cc1Br,C59198309_decoy,WEE1,Decoy,0.0,-10.0738,-7.84,-1.42,-8.1257462212915
CCCCC1(C)OC(=O)C(=Cc2cc(I)c(OCC(=O)[O-])c(OC)c2)C(=O)O1,C59337003_decoy,WEE1,Decoy,0.0,-8.82334,-5.08,-0.91,-4.929560809346731
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc([N+](=O)[O-])ccc3[O-])c(=O)n2[C@@H]1c1ccc(N(C)C)cc1,C59418524_decoy,WEE1,Decoy,0.0,-8.22945,-5.85,-1.24,-6.017283075702674
Cc1cc(/C=C2\C(=O)N(c3ccc(Br)cc3)C(=O)N=C2[O-])c(C)n1-c1ccc(N(C)C)cc1,C33343660_decoy,WEE1,Decoy,0.0,-7.41835,-7.82,-1.84,-6.045585602514111
N#CC(=C\c1cn(-c2ccccc2)nc1-c1cccs1)/C([O-])=N/c1cc2c(cc1[N+](=O)[O-])OCCO2,C09631028_decoy,WEE1,Decoy,0.0,-8.77755,-6.4,-0.81,-5.538414871590983
COc1ccc([C@@H]2C3=C([O-])CC(C)(C)CC3=NC3=NC(SCc4cccc([N+](=O)[O-])c4)=NC(=O)[C@H]32)cc1,C63448041_decoy,WEE1,Decoy,0.0,-9.77594,-6.28,-1.94,-5.228671411532974
COc1ccc([C@@H]2C(C#N)=C(SCC(=O)N3c4ccccc4C[C@@H]3C)N=C3CC(C)(C)CC([O-])=C32)cc1,C13175295_decoy,WEE1,Decoy,0.0,-7.6876,-7.21,-1.35,-5.8416747400150415
CCOC(=O)c1ccc(N2C(=O)C([O-])=C(S(=O)(=O)c3ccccc3)[C@H]2c2ccc(SC)cc2)cc1,C64557888_decoy,WEE1,Decoy,0.0,-9.7456,-7.49,-3.44,-7.881420538163112
COc1ccc([C@H]2C(S(=O)(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2ccc(Br)cc2)cc1,C64558185_decoy,WEE1,Decoy,0.0,-8.07737,-5.05,-3.86,-4.217140326212655
COC(=O)c1ccc([C@@H]2C(S(=O)(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2ccc(C(C)C)cc2)cc1,C64558249_decoy,WEE1,Decoy,0.0,-6.68322,-5.08,-2.55,-4.817228456117835
O=C(Nc1ccc(Oc2ccccc2)cc1)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2NC(=O)c1ccc(C(F)(F)F)cc1,C04235469_decoy,WEE1,Decoy,0.0,-6.42686,-10.19,-3.13,-6.580661177381867
Cc1cc2cc3c(cc2nc1SCC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1)OCCO3,C00933047_decoy,WEE1,Decoy,0.0,-10.0073,-9.76,-2.33,-10.03188093559828
O=C(N/N=C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1,C03338576_decoy,WEE1,Decoy,0.0,-7.7635,-5.96,-2.69,-5.010881192271641
C=CCN(C)C(=O)[C@@H](C)[C@@H]1CC[C@]2(C)Cc3sc(NS(=O)(=O)c4ccc(C)cc4)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840838_decoy,WEE1,Decoy,0.0,-8.10604,-8.38,-3.47,-6.776066090410061
C=CCN(C)C(=O)[C@@H](C)[C@@H]1CC[C@@]2(C)Cc3sc(NS(=O)(=O)c4ccc(C)cc4)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840837_decoy,WEE1,Decoy,0.0,-10.7404,-8.57,-2.45,-9.689340537541945
C=C1Nc2ccccc2N=C(NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)[C@H]1C(=O)OCC,C03417564_decoy,WEE1,Decoy,0.0,-10.9635,-8.62,-3.26,-8.810604447445343
N#Cc1c(NC(=O)c2nn3c(c2Br)N[C@H](c2ccco2)C[C@@H]3C(F)(F)F)sc2c1CCCC2,C00646959_decoy,WEE1,Decoy,0.0,-10.3919,-9.39,-3.67,-8.342540103289647
CCOC(=O)c1c(NC(=O)[C@@H](C)Sc2nnc3[nH]c(=O)cc(C(C)(C)C)n23)sc2c1CCCCC2,C09018787_decoy,WEE1,Decoy,0.0,-10.0169,-6.57,-1.7,-7.441068413411136
COC(=O)[C@H](Cc1ccccc1)NC(=O)CO/N=C1\C=C[C@@]2(C)C(=C1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O,C09033359_decoy,WEE1,Decoy,0.0,-9.61171,-9.13,-2.5,-7.73966500205643
CCOC(=O)NC(=O)c1c(NC(=O)c2ccc(Cc3ccccc3)cc2)sc2c1CCN(C(=O)OC)C2,C09325601_decoy,WEE1,Decoy,0.0,-9.08075,-6.58,-3.85,-6.392612172130948
Cc1cc(-c2nn(-c3ccccc3)cc2/C=C2\SC(N3CCC(C(N)=O)CC3)=NC2=O)ccc1OC(C)C,C12615192_decoy,WEE1,Decoy,0.0,-8.81701,-9.11,-1.03,-9.850933698125663
COc1cc([C@H](C(=O)NC2CCCC2)N(C(=O)c2ccc3c(c2)OCCO3)c2ccc(C)cc2C)ccc1O,C12637947_decoy,WEE1,Decoy,0.0,-8.70531,-5.2,-4.62,-5.3743111446919904
O=C(COC(=O)C1(c2ccc(Cl)cc2)CCC1)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1,C13075835_decoy,WEE1,Decoy,0.0,-9.0816,-9.23,-3.34,-9.82853123027486
O=C(Nc1ccc(F)cc1)c1ccccc1NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1,C15228019_decoy,WEE1,Decoy,0.0,-7.33049,-11.0,-3.87,-8.179891746510014
Cc1ccc(NC(=O)N2CCC3(CC2)C(=O)N(CC(=O)N[C@@H](C)c2ccccc2)CN3c2ccccc2)cc1,C16613172_decoy,WEE1,Decoy,0.0,-8.78029,-7.24,-2.6,-6.86938503265644
COC(=O)c1c(NC(=O)C2=C(C)NC3=C(C(=O)CCC3)[C@@H]2c2ccc3c(c2)OCO3)sc2c1CCCC2,C01427192_decoy,WEE1,Decoy,0.0,-9.68999,-9.11,-2.11,-7.887411996670783
CSc1nc(N(C[C@@H](C)O)C[C@@H](C)O)c2sc3nc(N4CCOCC4)c4c(c3c2n1)CC(C)(C)OC4,C20439253_decoy,WEE1,Decoy,0.0,-10.9944,-9.03,-2.44,-9.13568550106517
COc1cc([C@H]2Nc3ccc(S(=O)(=O)Nc4cc(C)cc(C)c4)cc3[C@H]3C=CC[C@H]32)ccc1OC(C)=O,C20702422_decoy,WEE1,Decoy,0.0,-9.34894,-10.19,-2.22,-8.070071197502052
CCOC(=O)c1c(NC(C)=O)sc2c(O[C@@H](C)C(=O)Nc3ccccc3C)c(Br)ccc12,C33113665_decoy,WEE1,Decoy,0.0,-9.12735,-8.26,-1.84,-8.073923452014371
COc1ccc(NC(=O)[C@H]2[C@H]3C=C[C@]4(O3)[C@H]2C(=O)N(C2CCCCC2)[C@@H]4C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)cc1,C34859702_decoy,WEE1,Decoy,0.0,-8.01939,-6.74,-2.72,-5.586493255812441
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC3CC[NH+](Cc4ccccc4)CC3)N2[C@H]1c1ccsc1,C34923794_decoy,WEE1,Decoy,0.0,-10.7953,-7.06,-3.39,-7.583528099870099
CC[C@H](C)NC(=O)CN1CN(c2ccccc2)C2(CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)C1=O,C35330527_decoy,WEE1,Decoy,0.0,-7.41946,-6.6,-3.62,-4.50247833006982
C=CCN(CC(=O)Nc1ccc(N2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1)C(=O)c1ccccc1F,C35664070_decoy,WEE1,Decoy,0.0,-10.411,-9.22,-2.6,-7.963701097552065
O=C(Nc1ccc(N2CCN(C(=O)NC3CCCCC3)CC2)c(C(=O)N2CCCCC2)c1)c1cccs1,C35664859_decoy,WEE1,Decoy,0.0,-9.85601,-7.12,-4.45,-6.599476435429788
O=C(Nc1cccc([C@H]2OC(=O)N(Cc3ccccc3)[C@@H]2C(=O)NCc2ccccc2)c1)c1ccc(F)cc1,C35754032_decoy,WEE1,Decoy,0.0,-8.34368,-8.73,-1.64,-7.585964889791385
Cc1ccc(CN2C(=O)O[C@@H](c3cccc(NC(=O)c4cccs4)c3)[C@H]2C(=O)NC[C@@H]2CCCO2)cc1,C35755521_decoy,WEE1,Decoy,0.0,-9.00646,-8.49,-3.57,-8.87589106973023
C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)N[C@H](C(=O)OC)c5ccccc5)CC[C@]4(C)[C@H]3CC[C@]21C,C35805069_decoy,WEE1,Decoy,0.0,-9.44771,-8.29,-3.87,-5.450107597549521
CCCN(CC(=O)Nc1ccc(N2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1)C(=O)c1ccc(F)cc1,C36013484_decoy,WEE1,Decoy,0.0,-10.0143,-7.02,-4.33,-7.315679475850158
CC(C)(C)NC(=O)N1CCN(c2ccc(NC(=O)c3ccc(Cl)cc3)cc2C(=O)N2CCCCC2)CC1,C36019575_decoy,WEE1,Decoy,0.0,-9.29843,-10.13,-1.83,-8.772992972844195
COCCN1C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(C(C)C)cc3)[C@H]3C=C[C@@]2(O3)[C@H]1C(=O)N[C@H]1CCC[C@H](C)[C@H]1C,C36066228_decoy,WEE1,Decoy,0.0,-9.6789,-5.97,-2.74,-7.052128972726869
O=C(N[C@H]1CCS(=O)(=O)C1)/C(=C\c1ccc(-c2ccc(Cl)cc2)o1)NC(=O)c1ccc(Cl)cc1,C02677911_decoy,WEE1,Decoy,0.0,-9.31888,-5.79,-4.17,-5.022154742343209
O=C(CSc1nnc(CNC(=O)C23CC4CC(CC(C4)C2)C3)n1-c1ccc(F)cc1)Nc1ccccc1,C08685155_decoy,WEE1,Decoy,0.0,-8.54192,-8.15,-1.94,-8.248138629500648
Cc1cccc(NC(=O)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCN(c3ccc(F)cc3)CC2)c1C,C38666268_decoy,WEE1,Decoy,0.0,-9.80531,-9.49,-2.8,-12.17358600998954
Cc1ccccc1OCC(=O)Nc1sc2c(c1C(=O)N[C@H]1CCS(=O)(=O)C1)CC[C@@H](C(C)(C)C)C2,C39836465_decoy,WEE1,Decoy,0.0,-10.1772,-8.76,-4.15,-9.220878681916268
COc1ccc(/C=C/C(=O)Nc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@@H](C(C)(C)C)C3)cc1,C39836483_decoy,WEE1,Decoy,0.0,-10.8278,-10.17,-4.45,-9.584465613873412
Cc1cc(C)cc(OCC(=O)Nc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@@H](C(C)(C)C)C3)c1,C39836511_decoy,WEE1,Decoy,0.0,-10.3968,-9.6,-3.4,-9.558771928103262
CCOc1cccc(C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CC[C@@H](C(C)(C)C)C3)c1,C39836533_decoy,WEE1,Decoy,0.0,-10.4872,-10.2,-4.28,-10.69916759324555
Cc1nn(Cc2ccccc2F)c(C)c1NC(=S)Nc1ccc(S(=O)(=O)N2[C@H](C)CCC[C@@H]2C)cc1,C39974397_decoy,WEE1,Decoy,0.0,-7.2938,-8.27,-2.09,-6.707109752657004
C[C@H]1CCc2c(sc(NC(=O)CCc3ncc(-c4ccccc4)o3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C41019552_decoy,WEE1,Decoy,0.0,-10.3305,-8.66,-3.64,-8.760423562090875
Cc1ccc2c(c1)N(S(C)(=O)=O)C[C@@H](C(=O)Nc1cccc(NC(=O)c3ccc(C(C)(C)C)cc3)c1)O2,C44939122_decoy,WEE1,Decoy,0.0,-8.84587,-10.45,-2.64,-9.589685883856353
CCCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CN(S(=O)(=O)c2ccc(C)cc2)CC3)cc1,C49511387_decoy,WEE1,Decoy,0.0,-8.94298,-9.07,-2.47,-9.159904398912015
CCc1c(C)sc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@H](c2ccc(OC)cc2)N3)c1C(=O)OC,C18210519_decoy,WEE1,Decoy,0.0,-8.57502,-8.16,-4.6,-8.47258580775354
CCOC(=O)C1=C(CSc2nc(C)c(C)c(C)c2C#N)OC(N)=C(C#N)[C@H]1c1ccccc1Br,C00705889_decoy,WEE1,Decoy,0.0,-9.45997,-7.09,-1.26,-7.453080381273688
CC(=O)Nc1ccc(N(C(=O)[C@H]2COc3ccccc3O2)[C@H](C(=O)NC2CCCCC2)c2ccc(C)cc2)cc1,C00930813_decoy,WEE1,Decoy,0.0,-8.67368,-5.66,-3.62,-6.024686341938068
CCOC(=O)c1c(N2C(N)=C(C#N)[C@@H](c3ccc(OC)c(OC)c3)C3=C2CC(C)(C)CC3=O)sc2c1CCCC2,C01059993_decoy,WEE1,Decoy,0.0,-8.56197,-4.47,-3.31,-5.2542196493496345
COc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccc(OC)c(OC)c2)N3)c1,C58849419_decoy,WEE1,Decoy,0.0,-9.63032,-9.48,-4.69,-6.115455463101557
COC(=O)c1ccc(NC(=O)C[C@H]2C(=O)N(c3ccc(F)cc3)C(=S)N2NC(=O)c2ccccc2)cc1,C33698941_decoy,WEE1,Decoy,0.0,-8.15282,-9.7,-2.63,-8.320426680500002
O=C(NC(=S)Nc1ccc2oc(-c3ccccc3F)nc2c1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1,C59331437_decoy,WEE1,Decoy,0.0,-10.1325,-9.68,-1.76,-15.563732076418626
COc1ccccc1NC(=S)N/C(=N\c1nc(C)cc(C)n1)N1CCN(c2cc(Cl)ccc2C)CC1,C14160389_decoy,WEE1,Decoy,0.0,-9.9791,-8.72,-3.65,-7.606222487171462
CCc1c(C)sc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@@H](c2ccc(OC)cc2)N3)c1C(=O)OC,C12850555_decoy,WEE1,Decoy,0.0,-8.65452,-7.97,-1.95,-8.873262403055126
CCOC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)sc2c1CC[NH+](CC)C2,C03007055_decoy,WEE1,Decoy,0.0,-10.1107,-7.7,-1.69,-8.025940134975523
COC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3)cc2)sc2c1CC[NH+](C(C)C)C2,C03007119_decoy,WEE1,Decoy,0.0,-10.8441,-9.28,-2.87,-12.892487788012325
C=CCN(CC=C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)OC)CC[NH+](C(C)C)C3)cc1,C03007126_decoy,WEE1,Decoy,0.0,-11.2315,-8.85,-0.74,-21.33972393333862
CC[C@@H](C)[NH+](CCNC(=O)CN1C(=O)COc2ccc(S(=O)(=O)N(CC)CC)cc21)C1CCCCC1,C09963303_decoy,WEE1,Decoy,0.0,-10.0881,-7.65,-3.6,-6.143474202550816
Cc1cc(CN(C)C(=O)COc2ccc(-c3ccc4c(c3)OCO4)cc2C[NH+](C)Cc2nonc2C)on1,C11881817_decoy,WEE1,Decoy,0.0,-9.08786,-7.95,-3.6,-7.265032333627804
O=C(COc1ccc(-c2cccs2)cc1C[NH+]1CCN(c2ncccn2)CC1)Nc1ccc2c(c1)COC2,C11998030_decoy,WEE1,Decoy,0.0,-9.96463,-10.35,-3.11,-8.897517951621959
CCc1ccc(C[NH+]2C[C@H](n3cc(C(=O)OC)nn3)C[C@H]2C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1,C12191054_decoy,WEE1,Decoy,0.0,-7.59655,-6.85,-4.77,-5.771969032027308
CCOc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CCSC)(C(=O)OC)[NH2+][C@H]3c2ccc(OC)cc2OC)cc1,C12497866_decoy,WEE1,Decoy,0.0,-10.6253,-5.66,-4.34,-6.90590226064255
COc1ccc(N2CC[NH+]([C@@H](c3cccs3)[C@H](C)NC(=O)c3cc(OC)c(OC)c(OC)c3)CC2)cc1,C09611938_decoy,WEE1,Decoy,0.0,-8.74349,-7.09,-3.66,-8.103107905540341
C[NH+](Cc1cccc(OC[C@H]2CCCN(C(=O)c3cn4ccsc4n3)C2)c1)Cc1ccc2ncccc2c1,C12246357_decoy,WEE1,Decoy,0.0,-8.76869,-5.1,-3.26,-5.176656032731097
COc1cc(C[NH2+][C@H]2CCc3cc(OC)c(OC)c(OC)c3-c3ccc(SC)c(=O)cc32)cc(OC)c1,C01631529_decoy,WEE1,Decoy,0.0,-9.42549,-5.15,-2.88,-5.846789739507885
CCOC(=O)C1CCN(c2nc3c(OC)ccc(OC)c3cc2C[NH2+]C[C@H]2COc3ccccc3O2)CC1,C14957159_decoy,WEE1,Decoy,0.0,-9.81296,-6.97,-2.3,-7.668859074695467
COc1ccc2cc(CN(Cc3ccco3)C(=O)c3ccc(NC(C)=O)cc3)c(N3CCCCCC3)[nH+]c2c1,C20271507_decoy,WEE1,Decoy,0.0,-7.71108,-8.71,-2.73,-8.410786657784485
COC(=O)c1ccc(CO[C@H](C[NH+]2CCN(C(=O)c3cccc(OC)c3)CC2)c2cccc(OC)c2)cc1,C23443981_decoy,WEE1,Decoy,0.0,-9.22402,-8.46,-3.58,-9.871957400882804
COc1cccc([C@H](C[NH+]2CCN(S(=O)(=O)c3cccc(OC)c3)CC2)OCc2ccc(C#N)cc2)c1,C23453946_decoy,WEE1,Decoy,0.0,-8.05898,-8.4,-2.46,-7.073184271998678
CC[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(C)C4CCCCC4)cc3)c2C(=O)OC)C1,C08880886_decoy,WEE1,Decoy,0.0,-10.2441,-9.3,-1.92,-9.345633951148232
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)c3ccc(C)cc3)CC2)N(CC)C(=O)N[C@@H]1c1cccc(F)c1,C35664213_decoy,WEE1,Decoy,0.0,-8.32117,-9.03,-3.65,-8.850267795172408
C=CCN1C(=O)N[C@H](c2ccccc2)C(C(=O)OCC)=C1C[NH+]1CCCN(C(=O)c2ccccc2F)CC1,C35664573_decoy,WEE1,Decoy,0.0,-6.9393,-6.38,-3.02,-4.624562987466957
C=CCN1C(=O)N[C@H](c2ccccc2)C(C(=O)OCC)=C1C[NH+]1CCCN(C(=O)c2cccc(OC)c2)CC1,C35664575_decoy,WEE1,Decoy,0.0,-9.22399,-7.13,-2.93,-8.22298039208755
COc1ccc(-c2cn(-c3ccc(C)cc3)/c(=N/C(=O)CN(CC[NH+](C)C)C(=O)c3ccc(F)cc3)[nH]2)cc1,C35694666_decoy,WEE1,Decoy,0.0,-8.32322,-8.33,-5.01,-7.975575314194145
COc1cc(NC(=O)[C@@H](C2CCCC2)[NH+]2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)cc(OC)c1,C35780122_decoy,WEE1,Decoy,0.0,-8.45004,-6.77,-3.35,-8.638382574364664
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)c3ccc(C)cc3)CC2)N(C)C(=O)N[C@H]1c1ccccc1OC,C35991923_decoy,WEE1,Decoy,0.0,-8.69306,-7.56,-3.04,-7.303894433857141
COc1cccc(C[NH+](Cc2ccc3c(c2)OCO3)Cc2nc(C(=O)N(C)Cc3ccccc3)co2)c1OC,C36065820_decoy,WEE1,Decoy,0.0,-8.33796,-8.49,-4.57,-7.728379138686761
CC(C)[NH+](CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(F)cc1)C[C@H](O)COCc1ccco1,C36309755_decoy,WEE1,Decoy,0.0,-9.03672,-7.87,-3.53,-7.968714871380313
COc1cccc2sc(N(CC[NH+](C)C)C(=O)c3ccc(S(=O)(=O)N4CCCC[C@@H]4C)cc3)nc12,C36637435_decoy,WEE1,Decoy,0.0,-10.4334,-7.88,-2.56,-8.144123336583286
CCOC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)sc2c1CC[NH+](C(C)C)C2,C03007163_decoy,WEE1,Decoy,0.0,-11.0576,-9.48,-1.3,-18.72587824845312
CN(C[C@@H](CC[NH+]1CC[C@@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1)c1ccccc1)S(=O)(=O)c1ccccc1,C38152417_decoy,WEE1,Decoy,0.0,-8.94011,-7.83,-3.52,-7.769799247267717
COc1ccc(/C=C2\SC(=S)N(CC(=O)NC[C@@H](c3ccc(OC)cc3)[NH+]3CCCCC3)C2=O)cc1,C38615218_decoy,WEE1,Decoy,0.0,-10.4115,-8.62,-2.24,-8.973312130384173
COc1cc([C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N[C@@H]2CC[NH+](Cc3ccccc3)C2)cc(OC)c1OC,C38737721_decoy,WEE1,Decoy,0.0,-9.63589,-8.41,-4.24,-8.203669907980577
CC[NH+](CC)CCN(C(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1)c1nc2ccccc2s1,C36690277_decoy,WEE1,Decoy,0.0,-9.80712,-8.63,-3.3,-10.644902011828089
CC[NH+](CC)CCN(C(=O)CCCSc1ccc(C)cc1)c1nc2ccc(S(C)(=O)=O)cc2s1,C38845452_decoy,WEE1,Decoy,0.0,-9.47567,-8.25,-2.21,-8.281559274885328
COc1cccc2sc(N(CC[NH+](C)C)C(=O)C3CCN(S(=O)(=O)c4ccc(F)cc4)CC3)nc12,C38847373_decoy,WEE1,Decoy,0.0,-9.87117,-9.18,-3.56,-10.099460832827372
COc1ccc(S(=O)(=O)N2CCC(C(=O)N(CC[NH+](C)C)c3nc4ccc(C)cc4s3)CC2)cc1,C38847429_decoy,WEE1,Decoy,0.0,-8.71843,-9.0,-4.13,-7.899332552989711
COc1ccc(-c2noc(C[NH+]3CCC[C@@H](C(=O)N4CCN(C/C=C/c5ccccc5)CC4)C3)n2)cc1OC,C38893362_decoy,WEE1,Decoy,0.0,-9.8076,-8.56,-4.35,-9.249468642726065
COc1ccc(-c2noc(C[NH+]3CCC[C@@H](C(=O)N[C@H](c4ccccc4)c4ccc(C)cc4)C3)n2)cc1OC,C38893562_decoy,WEE1,Decoy,0.0,-8.55542,-9.89,-3.42,-9.614125611474922
CC[C@H](NC(=O)[C@@H]1CCC[NH+](Cc2nc(-c3ccc(C(C)(C)C)cc3)no2)C1)c1ccc(OC)c(OC)c1,C38903893_decoy,WEE1,Decoy,0.0,-8.932,-8.82,-3.14,-8.235353492459161
C[C@H](NC(=O)[C@H]1CCC[NH+](Cc2nc(-c3ccc(C(C)(C)C)cc3)no2)C1)c1ccc(S(C)(=O)=O)cc1,C38903906_decoy,WEE1,Decoy,0.0,-9.46943,-9.83,-2.01,-8.101740986384604
O=C(NCCCSCc1ccco1)[C@@H]1CCC[NH+](Cc2nc(-c3cccc(Br)c3)no2)C1,C38904841_decoy,WEE1,Decoy,0.0,-10.126,-9.12,-4.29,-8.389789655736097
COc1ccc2c(c1)=C[C@@H](CN(CCc1ccccc1C)S(=O)(=O)c1ccc3c(c1)OCCO3)C(=O)[NH+]=2,C39325362_decoy,WEE1,Decoy,0.0,-8.48306,-7.09,-4.31,-6.189528441997644
CCC[NH+]1CCc2c(sc(NC(=O)[C@@H]3CCCCN3S(=O)(=O)c3cccs3)c2C(=O)OCC)C1,C36648024_decoy,WEE1,Decoy,0.0,-11.524,-4.5,-1.29,-7.160636310984162
CCOc1cccc2sc(N(CC[NH+](C)C)C(=O)[C@H]3CCCCN3S(=O)(=O)c3cccs3)nc12,C36648069_decoy,WEE1,Decoy,0.0,-8.30267,-4.68,-1.74,-5.472914118476649
COc1ccc(-c2nc(C[NH+]3CCC(C(=O)NCc4cccc(C(F)(F)F)c4)CC3)c(C)o2)cc1OC,C40984335_decoy,WEE1,Decoy,0.0,-7.77775,-7.48,-2.2,-6.545787743124844
CN(C)c1cc(N/N=C/c2cn(CCOc3ccc(C4CCCCC4)cc3)c3ccccc23)[nH+]c(N(C)C)n1,C41078040_decoy,WEE1,Decoy,0.0,-9.2476,-10.07,-1.86,-8.462023451518963
CC(=O)O[C@@]1(C(C)=O)CC[C@@H]2[C@H]3C=C(C)C4=C[C@H](OC(=O)CC[NH+]5CCCCC5)CC[C@@]4(C)[C@H]3CC[C@]21C,C43743318_decoy,WEE1,Decoy,0.0,-10.0082,-8.92,-4.1,-6.0131833116648
CC(C)OC(=O)N1CCC(COc2ccc(N3CCN(S(=O)(=O)CC4CCCCC4)CC3)[nH+]c2)CC1,C49068567_decoy,WEE1,Decoy,0.0,-9.90467,-8.27,-5.23,-6.502902090631565
CCCCC1=NN2C(=[NH2+])/C(=C/c3ccc(OCCOc4cc(C)cc(CC)c4)c(OC)c3)C(=O)N=C2S1,C27549385_decoy,WEE1,Decoy,0.0,-11.7738,-8.4,-1.68,-8.62683740456393
CC[C@@H](C)[C@H]1[NH2+]C2(CCN(S(=O)(=O)c3ccc(F)cc3)CC2)N(CCc2ccc(OC)c(OC)c2)C1=O,C36028118_decoy,WEE1,Decoy,0.0,-9.04911,-8.08,-3.35,-7.6286415733579105
COc1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccco2)C(=O)CC2=c3ccccc3=[NH+]C2)cc1OC,C63205566_decoy,WEE1,Decoy,0.0,-9.14752,-6.64,-2.52,-5.425455200261669
O=C(COC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1)C1=c2ccccc2=[NH+]C1,C39946296_decoy,WEE1,Decoy,0.0,-9.50248,-8.14,-3.82,-8.423848804293934
CC(C)(C)OC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)[C@@H]1N=N[C@@H](SCc2ccc(Cl)cc2Cl)O1,C63425574_decoy,WEE1,Decoy,0.0,-10.121,-8.75,-4.25,-11.735021228672018
CC1=C([C@@H](C)[NH+](Cc2ccccc2)Cc2ccccc2C#N)[C@@H](c2ccc(F)cc2)NC(=O)N1C,C04145772_decoy,WEE1,Decoy,0.0,-7.7813,-5.01,-2.14,-4.991297864452923
Cc1sc(NC(=O)c2ccco2)c([C@@H](c2ccc(F)cc2)[NH+]2CCN(c3ccccc3)CC2)c1C,C06144754_decoy,WEE1,Decoy,0.0,-8.51126,-5.65,-2.27,-6.076237424599492
O=C(c1ccccc1)[C@@H]1[C@H](C(=O)c2ccccc2)[NH+]2C=Cc3ccccc3[C@@H]2[C@]12C(=O)Nc1ccccc12,C08914331_decoy,WEE1,Decoy,0.0,-7.30316,-6.06,-3.47,-4.481951116734455
COc1ccc(Br)cc1C(=O)NC(=S)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C09696039_decoy,WEE1,Decoy,0.0,-9.26432,-4.83,-1.32,-5.61860419420934
COc1ccc(SCCC(=O)Nc2sc3c(c2-c2nc4ccccc4s2)CC[NH+](C)C3)cc1,C10031288_decoy,WEE1,Decoy,0.0,-10.668,-9.66,-3.15,-9.202201444848097
Cc1ccc(C[NH+]2CCC([C@]3(Cc4ccc(F)cc4)NC(=O)N(C4CCCC4)C3=O)CC2)s1,C12198175_decoy,WEE1,Decoy,0.0,-8.47492,-6.51,-3.87,-4.969457121771537
CC1CC[NH+]([C@H](CNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)c2cccs2)CC1,C12794406_decoy,WEE1,Decoy,0.0,-7.65832,-9.49,-2.13,-8.912867568182667
O=C(C[NH+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)Nc1ccccc1I,C12973203_decoy,WEE1,Decoy,0.0,-7.96732,-8.13,-3.03,-6.757961588488345
COc1ccc([C@H](c2c(NC(=O)c3ccccc3)sc(C)c2C)[NH+]2CCN(c3ccc(F)cc3)CC2)cc1,C12042994_decoy,WEE1,Decoy,0.0,-8.2296,-6.05,-1.76,-5.302679510979986
CC1CC[NH+]([C@H](c2ccc(Br)cc2)c2oc3ccccc3c2NC(=O)c2ccco2)CC1,C15859346_decoy,WEE1,Decoy,0.0,-8.68525,-7.86,-1.62,-8.67946571216375
CCCc1ccc(C(=O)[C@@H]2[C@H](C(=O)C(C)(C)C)[NH+]3C=Cc4ccccc4[C@@H]3[C@@]23C(=O)Nc2ccccc23)cc1,C16038851_decoy,WEE1,Decoy,0.0,-8.96816,-5.67,-2.28,-5.821889445081311
O=C(c1ccccc1)[C@@H]1[C@H](C(=O)c2ccccc2)[C@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C16039182_decoy,WEE1,Decoy,0.0,-7.17748,-6.51,-2.98,-4.224477049767335
O=C(N/N=C/c1ccc(Cl)cc1Cl)C1CCN(c2[nH+]cc(C(F)(F)F)cc2Cl)CC1,C03111070_decoy,WEE1,Decoy,0.0,-8.9473,-9.65,-2.0,-9.509508430342184
Cc1ccc(CN(C(=O)Nc2cccc(C(F)(F)F)c2)C2CC[NH+](Cc3ccccc3)CC2)o1,C20532302_decoy,WEE1,Decoy,0.0,-7.65737,-7.78,-3.26,-7.14693697415721
C[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1,C14067390_decoy,WEE1,Decoy,0.0,-8.62442,-7.98,-3.73,-7.485728101083562
CCOC(=O)c1c(/[NH+]=c2\oc3ccccc3cc2C(=O)Nc2ccc(F)cc2)sc2c1CCCC2,C27520941_decoy,WEE1,Decoy,0.0,-9.0179,-9.99,-2.94,-8.85700491460191
Cc1cccc(-c2noc(C[NH+]3CCC(C(=O)Nc4ccc(Br)cc4F)CC3)n2)c1,C30974518_decoy,WEE1,Decoy,0.0,-8.11999,-5.95,-2.25,-4.914854643550325
Cc1cccc(NC(=O)C2CC[NH+](Cc3nc(-c4cccc(Br)c4)no3)CC2)c1C,C30978323_decoy,WEE1,Decoy,0.0,-8.62678,-9.45,-2.84,-9.087914838792464
Cc1ccc(S(=O)(=O)N(c2ccc(C)c(F)c2)C2CC[NH+](Cc3ccccc3O)CC2)cc1,C34684007_decoy,WEE1,Decoy,0.0,-8.76509,-5.58,-2.19,-5.5041327851564725
O=C(Nc1ccc(F)cc1)C1CC[NH+](C2CCN(C(=O)c3ccc(Cl)c(Cl)c3)CC2)CC1,C34912078_decoy,WEE1,Decoy,0.0,-9.92335,-6.08,-4.3,-5.965908033351716
Cc1ccc(-c2nc(N3CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)c(C)c(C)[nH+]2)cc1,C35890752_decoy,WEE1,Decoy,0.0,-6.58038,-9.57,-3.0,-6.823800283757125
Cc1ccc(-c2nc(N3CCN(C(=O)Nc4ccccc4C(F)(F)F)CC3)c(C(C)C)c(C)[nH+]2)cc1,C35890866_decoy,WEE1,Decoy,0.0,-7.9183,-9.69,-1.76,-8.036314868684084
Cc1[nH+]c(-c2ccc(C(F)(F)F)cc2)nc(N2CCN(C(=O)Nc3ccccc3F)CC2)c1C(C)C,C35890990_decoy,WEE1,Decoy,0.0,-7.63426,-6.42,-2.8,-5.1006321411503714
CC(C)(C)c1ccc(C(=O)N2CC[NH+]([C@@H](C(=O)Nc3ccc(F)cc3F)C3CCCC3)CC2)cc1,C36312029_decoy,WEE1,Decoy,0.0,-8.57589,-9.3,-3.97,-9.39696675901838
C[NH2+][C@H]1CCN(c2ccc(-n3ncc4cc(-c5ccc(C(F)(F)F)cc5)sc4c3=O)cn2)C1,C36351527_decoy,WEE1,Decoy,0.0,-9.37825,-9.04,-1.59,-7.2486470577392
FC(F)Oc1ccccc1/C=C1\CCCC2=C1[NH+]=C1N=CNN1[C@H]2c1ccccc1OC(F)F,C12561594_decoy,WEE1,Decoy,0.0,-7.80922,-7.32,-1.84,-8.602480969769061
CSC1=NC2=[NH+]C3=C([C@@H](c4ccc(SC)cc4)Oc4ccccc43)[C@@H](c3ccc(C)cc3)N2N1,C09346182_decoy,WEE1,Decoy,0.0,-6.58496,-4.74,-3.81,-3.4509319441738
O=C(Nc1cccc2c1C(=O)c1cccc3c1=C2[C@H](C(=O)c1ccccc1)C(=O)[NH+]=3)c1ccccc1,C08870635_decoy,WEE1,Decoy,0.0,-8.4141,-8.5,-0.12,-5.95942156334315
O=C(CCN1c2ccccc2[C@@H](c2ccccc2)[C@H]1c1ccccc1)N/N=C/C1=c2ccccc2=[NH+]C1,C38811799_decoy,WEE1,Decoy,0.0,-9.23804,-9.83,-1.78,-9.993133960301874
C[C@@H]1[C@@H](NC(=O)C2CC[NH+](Cc3c(-c4ccccc4)nc4ccccn34)CC2)C[C@H]2C[C@@H]1C2(C)C,C39198245_decoy,WEE1,Decoy,0.0,-7.2293,-9.53,-3.52,-7.847460121896556
Cc1cc(C)cc(NC(=O)c2ccc(-c3ccc4c(c3)C(=O)CC3(CC[NH+](C(C)C)CC3)O4)cc2)c1,C39227318_decoy,WEE1,Decoy,0.0,-9.8157,-6.14,-1.88,-6.449982768320542
COc1cc(C[NH2+]Cc2ccc3c(c2)OCO3)cc(Br)c1OCc1cccc(C)c1,C40733284_decoy,WEE1,Decoy,0.0,-8.69188,-8.96,-2.27,-7.478490758238475
C[C@@H]1CCCN(C(=O)CS[C@H]2NN=C(C3=c4ccccc4=[NH+]C3)N2c2ccc(Cl)cc2)C1,C44658374_decoy,WEE1,Decoy,0.0,-10.6594,-5.56,-2.18,-6.932949140589851
CC[C@H](C)CN1C(=O)[C@@H](C(C)C)[NH2+]C12CCN(S(=O)(=O)c1ccc(Cl)c(Cl)c1)CC2,C36024594_decoy,WEE1,Decoy,0.0,-10.2839,-7.97,-3.09,-9.366376039064992
Cc1cc(N2CCN([C@@H](C)C(=O)Nc3ccc(Cl)cc3C(F)(F)F)CC2)nc(C(C)C)[nH+]1,C27545816_decoy,WEE1,Decoy,0.0,-8.09635,-8.03,-2.64,-6.152979423570453
Cc1ccc(-c2csc(SCC(=O)Nc3ccccc3N3CC[NH+](C4CCCCC4)CC3)n2)cc1,C59218814_decoy,WEE1,Decoy,0.0,-9.21998,-9.21,-0.94,-7.555034844838548
CC(C)c1ccc([C@@H]2[C@@H]3[NH+]=c4ccccc4=C3C[C@@H]3C(=O)N(C[C@H](O)c4ccccc4)CC(=O)N32)cc1,C63137374_decoy,WEE1,Decoy,0.0,-7.73247,-5.77,-3.92,-4.328288947020007
O=S(=O)(/N=C1\N=c2ccccc2=[NH+][C@@H]1Nc1cccc(F)c1)c1ccc(Br)cc1,C39977209_decoy,WEE1,Decoy,0.0,-8.08401,-10.27,-1.98,-9.2306785235671
CCOC(=O)C1CCC(CNC(=O)N2CCC3=c4ccccc4=[NH+][C@@H]3[C@@H]2c2ccc(F)cc2)CC1,C63571860_decoy,WEE1,Decoy,0.0,-9.83763,-6.43,-4.83,-7.455085879070905
CCOC(=O)C1CCC(CNC(=O)N2CCC3=c4ccccc4=[NH+][C@H]3[C@H]2c2ccc(F)cc2)CC1,C63571867_decoy,WEE1,Decoy,0.0,-8.54555,-6.26,-5.05,-5.691182226537909
CCOC(=O)CC1(NC(=O)N2CCC3=c4ccccc4=[NH+][C@H]3[C@@H]2c2ccc(F)cc2)CCCCC1,C63571878_decoy,WEE1,Decoy,0.0,-7.04634,-5.59,-4.0,-3.316166162400008
COc1ccc([C@H]2[C@H]3[NH+]=c4ccc(OC)cc4=C3CCN2C(=O)Nc2ccc(C)cc2Cl)cc1,C63572982_decoy,WEE1,Decoy,0.0,-8.21064,-5.53,-1.99,-5.172309702339434
COc1ccc([C@@H]2[C@@H]3[NH+]=c4ccc(OC)cc4=C3CCN2C(=O)Nc2ccc(C)cc2Cl)cc1,C63572987_decoy,WEE1,Decoy,0.0,-8.81993,-5.28,-3.07,-5.481816568748394
COc1ccc([C@H]2[C@H]3[NH+]=c4ccc(OC)cc4=C3CCN2C(=O)Nc2cc(Cl)ccc2C)cc1,C63573012_decoy,WEE1,Decoy,0.0,-9.11009,-5.56,-3.16,-6.378662528748866
Cc1cc(N[C@H]2[NH+]=c3ccccc3=N/C2=N\S(=O)(=O)c2ccccc2)ccc1Br,C38965412_decoy,WEE1,Decoy,0.0,-9.22941,-10.24,-2.0,-10.150575324703082
O=S(=O)(/N=C1\N=c2ccccc2=[NH+][C@H]1Nc1ccc(Br)cc1F)c1ccc(F)cc1,C38965547_decoy,WEE1,Decoy,0.0,-7.11835,-6.47,-1.45,-4.676213425738299
Cc1ccc(C)c(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@@H]2Nc2ccccc2Br)c1,C38970725_decoy,WEE1,Decoy,0.0,-8.64997,-9.56,-3.65,-8.275880784268587
Cc1ccc(C)c(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@H]2Nc2cccc(Br)c2)c1,C38971821_decoy,WEE1,Decoy,0.0,-8.3815,-10.22,-3.7,-8.277385532660023
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)c1cc(-c2ccc(Br)cc2)nc2ccccc12,C63773013_decoy,WEE1,Decoy,0.0,-8.44451,-11.13,-1.69,-8.86090131106118
COc1ccc(C[C@H]2Nc3ccccc3N2C2CCN(C(=O)CC3=c4ccccc4=[NH+]C3)CC2)cc1,C64066821_decoy,WEE1,Decoy,0.0,-8.73153,-10.09,-2.05,-7.867667087677637
CC1(C)[C@@H]([N+](=O)[O-])[C@@H](c2ccc(Br)cc2)[NH2+][C@H](c2ccc(Br)cc2)[C@@H]1[N+](=O)[O-],C06232740_decoy,WEE1,Decoy,0.0,-6.11747,-5.69,-3.48,-4.850791128820288
Cc1ccc(C(=O)[C@@H]2[C@H](c3cccc([N+](=O)[O-])c3)[C@@H]3CSC[NH+]3[C@@]23C(=O)Nc2ccc(C)cc23)cc1,C08684788_decoy,WEE1,Decoy,0.0,-8.00769,-5.94,-4.32,-5.3685200834949445
COc1cc2c(cc1OC)[C@H](c1cccs1)[NH+](CN1C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C1=O)CC2,C08851286_decoy,WEE1,Decoy,0.0,-9.18765,-5.85,-1.94,-4.561270210522026
COc1ccc(Cl)cc1NC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@H]2c3ccccc3C=C[NH+]12,C09159190_decoy,WEE1,Decoy,0.0,-8.49212,-5.73,-3.18,-5.180227369185872
CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC[NH+](C(C)C)C3)cc1,C09383371_decoy,WEE1,Decoy,0.0,-10.9702,-10.24,-2.08,-16.344301336171924
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C[NH+]1CCC[C@@H]1c1nc2ccccc2s1,C09884413_decoy,WEE1,Decoy,0.0,-10.816,-8.47,-3.22,-8.633410162409854
COc1ccc(CN(Cc2cc3ccc(F)cc3[nH+]c2N2CCC(O)CC2)C(=O)c2ccc(C)cc2)cc1,C12037387_decoy,WEE1,Decoy,0.0,-10.2566,-9.64,-2.48,-9.054124883421222
Cc1cc(C)c2[nH]c(=O)c([C@H](c3nnnn3C3CCCCC3)[NH+]3CC=C(c4ccc(F)cc4)CC3)cc2c1,C06300988_decoy,WEE1,Decoy,0.0,-8.04428,-9.49,-2.8,-7.113843093542705
CS(=O)(=O)c1ccc(CN(C(=O)Nc2ccc(F)cc2F)C2CC[NH+](Cc3ccccc3)CC2)cc1,C16080235_decoy,WEE1,Decoy,0.0,-8.91306,-8.63,-4.1,-8.247109040981146
O=C(Nc1ccc2c(c1)OCO2)C1CC[NH+](Cc2cc(F)cc3c2O[C@H](c2ccsc2)OC3)CC1,C16695580_decoy,WEE1,Decoy,0.0,-9.49412,-7.66,-3.59,-6.618521756867684
C[C@@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)[NH+]1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1,C18709984_decoy,WEE1,Decoy,0.0,-8.58546,-8.18,-1.69,-7.286068230034663
O=C(C[NH+]1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1)NN=Cc1ccc(Cl)cc1,C19850513_decoy,WEE1,Decoy,0.0,-9.1785,-8.47,-3.67,-8.507600921947166
O=S(=O)(N[C@H]1CCCC[C@@H]1[NH+]1CCN(Cc2ccc3c(c2)OCO3)CC1)c1ccc(Cl)cc1,C20441788_decoy,WEE1,Decoy,0.0,-9.02248,-6.26,-3.51,-4.9775382028970325
O=S(=O)(N[C@H]1CCCC[C@H]1[NH+]1CCN(Cc2ccc3c(c2)OCO3)CC1)c1ccc(Cl)cc1,C20441797_decoy,WEE1,Decoy,0.0,-9.38406,-6.06,-3.77,-5.5304541583515485
C[NH+]1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@@H](c2cc([N+](=O)[O-])ccc2Cl)N3)CC1,C20705941_decoy,WEE1,Decoy,0.0,-7.14608,-11.02,-2.79,-9.839277174557498
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)[NH+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1,C15030670_decoy,WEE1,Decoy,0.0,-8.77811,-9.35,-2.85,-9.001113815931703
C[C@@H](C(=O)NC1CC1)[NH+]1CCN(c2nc(/C=C/c3ccccc3)nc3sc4c(c23)CCCC4)CC1,C22195979_decoy,WEE1,Decoy,0.0,-10.9499,-9.07,-1.06,-15.486796383052694
O=C(C[NH+]1CCN(CC(=O)N2c3ccccc3OC[C@@H]2c2ccccc2)CC1)Nc1cccc(F)c1,C22925280_decoy,WEE1,Decoy,0.0,-6.70596,-8.08,-5.06,-4.066518143088115
O=C(C[NH+]1CCN(CC(=O)N2c3ccccc3OC[C@H]2c2ccccc2)CC1)Nc1cccc(F)c1,C22925285_decoy,WEE1,Decoy,0.0,-6.46972,-8.82,-3.94,-6.938102988451798
Cc1cc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(Cl)cc3)C2)ccc1N1CC[NH+](C)CC1,C25149017_decoy,WEE1,Decoy,0.0,-10.4372,-9.86,-1.81,-13.283015932110269
Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)C(=O)c1c(C)nn(-c2cccc(C(F)(F)F)c2)c1C,C29370934_decoy,WEE1,Decoy,0.0,-8.57026,-9.4,-1.24,-15.71053557346548
Cc1ccc(C)c([C@@H](C)NC(=O)C2CC[NH+](Cc3nc(-c4ccc(Br)cc4)no3)CC2)c1,C30979475_decoy,WEE1,Decoy,0.0,-8.16135,-6.13,-2.32,-5.604856199708862
CCC(=O)N1CCc2ccc(OCc3ccc(C(=O)N4CC[NH2+][C@H](C)C4)o3)cc2[C@@H]1c1cccc(F)c1,C35863308_decoy,WEE1,Decoy,0.0,-9.8562,-8.3,-3.01,-7.651127147559392
CCC(=O)N1CCc2ccc(OCc3ccc(C(=O)N4CC[NH2+][C@@H](C)C4)o3)cc2[C@@H]1c1cccc(F)c1,C35863310_decoy,WEE1,Decoy,0.0,-10.2055,-9.33,-3.07,-10.15086034742732
CC(C)c1ccc(NC(=O)[C@H](C2CCCC2)[NH+]2CCN(C(=O)c3cccc(Br)c3)CC2)cc1,C36311773_decoy,WEE1,Decoy,0.0,-9.90102,-9.07,-2.69,-9.069913959488748
O=C(Nc1ccc2c(c1)OCO2)[C@@H](C1CCCC1)[NH+]1CCN(C(=O)c2cccc(Br)c2)CC1,C36311939_decoy,WEE1,Decoy,0.0,-10.0783,-7.91,-2.37,-8.594152722995197
O=C(Nc1ccc2c(c1)OCO2)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1,C36311943_decoy,WEE1,Decoy,0.0,-8.60028,-7.7,-2.73,-7.750102039085639
CC(=O)/[NH+]=c1/ccc2c(CSc3nnc(-c4cccs4)n3Cc3ccccc3)cc(O)oc-2c1,C36799235_decoy,WEE1,Decoy,0.0,-10.9281,-6.18,-1.42,-6.27399777818777
O=C(NC[C@H](c1ccco1)[NH+]1CCN(c2ccc(F)cc2)CC1)C1(c2ccc(Cl)cc2)CCCC1,C38597733_decoy,WEE1,Decoy,0.0,-9.6081,-6.99,-2.47,-6.680213900422168
O=C(N[C@H](c1ccccc1)c1ccc(Cl)cc1)[C@H]1CCCC[C@@H]1C(=O)N1CCN(c2cccc[nH+]2)CC1,C38732214_decoy,WEE1,Decoy,0.0,-8.80171,-9.19,-2.5,-7.907941101601518
CC(C)c1ccc(C[NH+]2CCC(O)(c3ccc4oc(C(=O)N5C[C@@H](C)O[C@@H](C)C5)cc4c3)CC2)cc1,C14991263_decoy,WEE1,Decoy,0.0,-9.7849,-9.62,-1.81,-7.711951240415885
CSC1=C[C@H]2C[C@@H]3CO[P@](=O)(Cc4ccccc4)N[NH+]3C[C@@H]2C=C1S(=O)(=O)Oc1ccccc1,C39466690_decoy,WEE1,Decoy,0.0,-9.42218,-9.38,-2.02,-8.440104672935625
CSC1=C[C@@H]2C[NH+]3N[P@@](=O)(Cc4ccccc4)OC[C@@H]3C[C@@H]2C=C1S(=O)(=O)Oc1ccccc1,C39466948_decoy,WEE1,Decoy,0.0,-7.04375,-7.8,-3.69,-5.626406650068107
COc1cc(C(=O)N[C@H]2C(=O)[NH+]=c3ccc(Br)cc3=C2c2ccccc2)cc(OC)c1OC,C39707617_decoy,WEE1,Decoy,0.0,-8.31446,-5.3,-0.54,-4.949436653662469
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)c1ccc(S(=O)(=O)c2ccc(Br)cc2)o1,C40323012_decoy,WEE1,Decoy,0.0,-9.18358,-9.4,-3.33,-12.380888416423074
C[C@@]12CCC[C@@]3(CO3)[C@H]1C[C@H]1[C@@H](C2)OC(=O)[C@@H]1C[NH+]1CCC[C@@H]1C(O)(c1ccccc1)c1ccccc1,C43746352_decoy,WEE1,Decoy,0.0,-7.23986,-8.43,-1.88,-6.795681733405225
COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)[C@@H]1CCC[NH+](Cc2ccccc2F)C1,C44882327_decoy,WEE1,Decoy,0.0,-9.41442,-8.11,-5.03,-5.310962856707076
C[C@@H]1CN(c2ccc(CNC(=O)Cc3csc(-c4ccc(C(F)(F)F)cc4)n3)c[nH+]2)C[C@@H](C)O1,C46841262_decoy,WEE1,Decoy,0.0,-8.95742,-9.94,-1.89,-8.850973952332112
Cc1ccc(C2=NN(C(=[NH2+])S[C@@H]3CC(=O)N(c4cccc(C)c4)C3=O)[C@@H](c3ccc(Cl)cc3)C2)cc1,C18180816_decoy,WEE1,Decoy,0.0,-9.21719,-8.18,-3.94,-6.846967850356289
C[C@H](NC(=O)CN1CCN(Cc2cc(=O)n3ccsc3[nH+]2)CC1)c1ccc(-c2ccccc2)cc1,C22914041_decoy,WEE1,Decoy,0.0,-10.6539,-8.73,-2.12,-8.646374205131952
COC(=O)[C@@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)CN1CCN(c2cccc(C)c2C)CC1,C39582255_decoy,WEE1,Decoy,0.0,-8.13463,-8.47,-2.18,-8.569573734516739
C[C@@H]1[NH+]=c2ccc(OC(F)(F)F)cc2=C1CCNC(=O)C1CCN(C(=O)c2ccccc2F)CC1,C63293935_decoy,WEE1,Decoy,0.0,-9.10415,-10.39,-3.8,-8.866199734608855
O=S(=O)(/N=C1\N=c2ccccc2=[NH+][C@@H]1Nc1ccccc1Cl)c1ccc(Br)cc1,C39977440_decoy,WEE1,Decoy,0.0,-8.72529,-9.48,-3.15,-8.45004401368173
Cc1ccccc1[C@@H]1[C@@H]2[NH+]=c3ccccc3=C2C[C@H]2C(=O)N(c3ccccc3C(=O)NC3CCCC3)C(=O)N12,C63375980_decoy,WEE1,Decoy,0.0,-7.16026,-6.46,-3.09,-5.439005817569522
O=C1[C@H]2C3=C(CCCC3)S[C@H]2N[C@H](SCC2=c3ccc([N+](=O)[O-])cc3=[NH+]C2)N1c1ccccc1,C63503289_decoy,WEE1,Decoy,0.0,-10.0153,-8.47,-2.29,-9.061517582846166
COc1ccc([C@@H]2[C@@H]3[NH+]=c4ccc(OC)cc4=C3CCN2C(=O)Nc2cc(Cl)ccc2OC)cc1,C63572993_decoy,WEE1,Decoy,0.0,-8.41223,-6.08,-2.88,-6.539363405981965
COc1ccc([C@H]2[C@@H]3[NH+]=c4ccc(Cl)cc4=C3CCN2C(=O)Nc2ccc3c(c2)OCCO3)cc1,C64623131_decoy,WEE1,Decoy,0.0,-8.40273,-6.12,-1.74,-5.710565732692719
COC(=O)c1cccc(NC(=O)N2CCC3=c4cc(Cl)ccc4=[NH+][C@@H]3[C@@H]2c2ccc(OC)cc2)c1,C64623137_decoy,WEE1,Decoy,0.0,-8.43216,-7.42,-2.14,-6.772318436464243
COC(=O)c1cccc(NC(=O)N2CCC3=c4cc(Cl)ccc4=[NH+][C@H]3[C@H]2c2ccc(OC)cc2)c1,C64623138_decoy,WEE1,Decoy,0.0,-9.10718,-5.48,-2.04,-5.315676102097397
COc1ccc(Br)cc1S(=O)(=O)NC[C@H](C1=c2ccccc2=[NH+]C1)c1cccs1,C64713758_decoy,WEE1,Decoy,0.0,-10.2838,-8.01,-2.27,-9.30006969555432
[NH2+]=C(NS(=O)(=O)c1cc(Cl)c(Oc2ccc([N+](=O)[O-])cc2)c(Cl)c1)c1ccc(Cl)cc1,C01040684_decoy,WEE1,Decoy,0.0,-10.0584,-9.46,-2.04,-10.5909919284343
CCOC(=O)N1CCc2c(sc(NC(=O)C[NH+]3CCC(C)CC3)c2C(=O)Nc2ccccc2C)C1,C08918707_decoy,WEE1,Decoy,0.0,-9.15475,-7.01,-3.52,-7.383053547273649
CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH+]2CCc3sccc3[C@@H]2c2cccs2)C1=O,C09155191_decoy,WEE1,Decoy,0.0,-8.47801,-9.33,-2.37,-8.893320951546647
NC(=O)C1CC[NH+](CC(=O)N2N=C3/C(=C/c4cccs4)CCC[C@H]3[C@H]2c2cccs2)CC1,C09846785_decoy,WEE1,Decoy,0.0,-10.6662,-7.5,-3.29,-8.260053599453938
COc1ccc(OC)c(NC(=O)c2cc3cc(C4(O)CC[NH+](C[C@@H]5CC=CCC5)CC4)ccc3o2)c1,C12155728_decoy,WEE1,Decoy,0.0,-10.6075,-8.16,-2.5,-9.390320818791515
COc1ccc(Cl)cc1NC(=O)c1c(NC(=O)C[NH+]2CCCC[C@H]2C)sc2c1CCCC2,C15946859_decoy,WEE1,Decoy,0.0,-9.96365,-8.95,-4.29,-10.137129338457717
COc1cc([C@H]2[C@@H]3CCCC[C@@]3(O)CC[NH+]2CC(=O)Nc2cc(C)ccc2C)cc(OC)c1OC,C15958442_decoy,WEE1,Decoy,0.0,-10.204,-5.57,-3.43,-5.192214592612846
O=C(C[C@H]1C(=O)NCCN1C(=O)C[NH+]1CCN(c2ccc(F)cc2)CC1)Nc1cc(Cl)cc(Cl)c1,C19961918_decoy,WEE1,Decoy,0.0,-9.62913,-8.77,-3.79,-7.994777651860825
O=C(Nc1ccc(N2CC[NH2+]CC2)c([N+](=O)[O-])c1)c1cc(I)ccc1Cl,C20154247_decoy,WEE1,Decoy,0.0,-8.23434,-9.14,-0.68,-11.748808104324471
C[C@H](C(=O)N1CCSCC1)[C@@H]1CC[C@@]2(C)Cc3s/c(=N\C(=O)C[NH+](C)C)[nH]c3[C@@H](C)[C@@H]2[C@H]1O,C20504575_decoy,WEE1,Decoy,0.0,-10.6725,-5.44,-3.41,-4.985043403425392
OC[C@H]1CCCN(c2nc3cc4c(cc3cc2C[NH2+]Cc2ccc(C(F)(F)F)cc2)OCO4)C1,C20784039_decoy,WEE1,Decoy,0.0,-9.12884,-8.42,-3.35,-8.376410423020792
Cc1ccc2nc(-c3ccc(NC(=O)CN4CCC[NH+](CC(=O)NC(C)C)CC4)cc3)sc2c1,C22913452_decoy,WEE1,Decoy,0.0,-9.64023,-7.82,-2.84,-7.356804422786362
COc1ccc(NC(=O)NC(=O)C[NH+]2CCc3cc(OC)c(OC)cc3[C@@H]2c2cccs2)cc1,C25392216_decoy,WEE1,Decoy,0.0,-9.07575,-8.27,-1.74,-7.485750495185947
CC[NH+]1CCN(c2ccc(NC(=O)CN3C(=O)N[C@]4(C[C@H](C)CC(C)(C)C4)C3=O)c(C)c2)CC1,C29373749_decoy,WEE1,Decoy,0.0,-9.2545,-8.8,-1.7,-10.774929896448016
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccc(NC(=O)C3CCCC3)c2)N2CCCSC2=[NH+]1,C33727842_decoy,WEE1,Decoy,0.0,-9.69194,-5.9,-1.76,-6.221778760878424
Cc1ccc(S(=O)(=O)N2CCCN(c3ccc(NC(=O)Nc4ccc(F)c(F)c4)c[nH+]3)CC2)cc1,C34681405_decoy,WEE1,Decoy,0.0,-9.28823,-10.16,-3.65,-6.84371856801125
CCc1c(C)sc2nc(SCC(N)=O)nc(N3CC[NH+](Cc4ccc(C)cc4C)CC3)c12,C34762182_decoy,WEE1,Decoy,0.0,-10.3726,-7.68,-3.67,-8.2553390815947
CNC(=O)C1=C(C)[NH+]=C2SCCCN2[C@@H]1c1ccc(NC(=O)c2ccc(OC)cc2OC)cc1,C35337733_decoy,WEE1,Decoy,0.0,-8.43017,-8.71,-1.55,-7.944281184837818
COC(=O)[C@H](CCSC)NC(=O)N1CCc2[nH]c[nH+]c2[C@@H]1c1ccc(Br)cc1F,C20745141_decoy,WEE1,Decoy,0.0,-11.4587,-5.23,-1.82,-5.917614211921102
O=C(Nc1ccc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)[nH+]c1)Nc1ccc(F)cc1F,C37588276_decoy,WEE1,Decoy,0.0,-8.96161,-9.75,-2.25,-6.599250626629957
CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccccn2)N2NC(SCc3ccccc3)=NC2=[NH+]1,C09781159_decoy,WEE1,Decoy,0.0,-8.2613,-5.78,-1.88,-5.0494239709508015
CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccccn2)N2NC(SCc3ccccc3)=NC2=[NH+]1,C09781164_decoy,WEE1,Decoy,0.0,-9.00094,-5.98,-2.66,-5.256954002847935
O=C(NCc1ccc2c(c1)OCO2)C1=CC2=[NH+][C@@H](c3ccc(Cl)cc3)C[C@@H](C(F)(F)F)N2N1,C03012012_decoy,WEE1,Decoy,0.0,-8.14658,-9.19,-3.93,-8.736690022934786
O=C(NC1CCCC1)c1ccc(N2CCC([NH2+]C[C@@H]3C=NN=C3c3ccc(Cl)cc3)CC2)cc1,C39445833_decoy,WEE1,Decoy,0.0,-10.8627,-6.36,-2.27,-6.252883036166527
COC(=O)[C@@H]1CC2=C3CC=CC=C3N=C2[C@H]2C[C@@H]([NH2+]CCc3c[nH]cn3)C[C@@H](c3cccc(Cl)c3)N21,C39560770_decoy,WEE1,Decoy,0.0,-7.82266,-5.37,-4.34,-4.802018380113877
Cc1ccc(CNC(=O)[C@H]2CN(C(=O)[C@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)c(C)c1,C39607260_decoy,WEE1,Decoy,0.0,-7.95297,-8.65,-3.07,-7.928258988894967
O=C(N[C@@H]1CCC[C@H]1OCc1ccccc1)[C@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CC12CC[NH2+]CC2,C39608845_decoy,WEE1,Decoy,0.0,-8.77357,-7.46,-3.78,-7.322951606586188
Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)c(F)c3)CC23CC[NH2+]CC3)cc1,C39666026_decoy,WEE1,Decoy,0.0,-8.13264,-9.79,-2.75,-7.620742322752386
O=C(NCc1ccc(OC(F)F)cc1)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39673398_decoy,WEE1,Decoy,0.0,-7.57006,-9.51,-2.87,-6.308874603872978
COc1ccc(CC[C@@H](C)NC(=O)[C@H]2CN(C(=O)c3ccc(Br)cc3)CC23CC[NH2+]CC3)cc1,C39675277_decoy,WEE1,Decoy,0.0,-9.47427,-8.91,-2.24,-8.457459645186713
COc1ccc(C(NC(=O)[C@@H]2CN(C(=O)[C@@H]3CC=CCC3)CC23CC[NH2+]CC3)c2ccc(OC)cc2)cc1,C39676590_decoy,WEE1,Decoy,0.0,-9.24711,-10.52,-1.81,-9.58375569553902
O=C(NCCOc1cccc(F)c1)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39685465_decoy,WEE1,Decoy,0.0,-9.15816,-9.5,-2.15,-8.511978708839123
C[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39688671_decoy,WEE1,Decoy,0.0,-9.29951,-7.83,-2.71,-7.959959116997044
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)NCc2ccccc2Br)C2(CC[NH2+]CC2)C1,C39690759_decoy,WEE1,Decoy,0.0,-9.07976,-6.45,-3.71,-5.719512789838848
COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)NCc3cc(C)cc(C)c3)C3(CC[NH2+]CC3)C2)cc1Cl,C39694883_decoy,WEE1,Decoy,0.0,-7.61393,-8.96,-2.77,-7.769196166131367
CCc1ccc([C@@H](C)NC(=O)[C@H]2CN(C(=O)c3cc(OC)ccc3Br)CC23CC[NH2+]CC3)cc1,C39696160_decoy,WEE1,Decoy,0.0,-9.16483,-8.95,-2.55,-9.872204424932242
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@]21C,C43741659_decoy,WEE1,Decoy,0.0,-10.2751,-9.41,-1.72,-9.33177534335378
Nc1nc(C[NH+]2CCCN(c3ccc(C(F)(F)F)cn3)CC2)nc2sc3c(c12)CCCCC3,C45606242_decoy,WEE1,Decoy,0.0,-9.20513,-5.45,-1.66,-4.561369036885616
Cc1ccc2nc(-c3ccc(NC(=O)C[NH+]4CCC[C@@H]4C(=O)NCc4ccco4)cc3)sc2c1,C31557491_decoy,WEE1,Decoy,0.0,-9.11746,-8.76,-2.08,-6.945100473215798
COc1cc(Br)ccc1[C@H]1C(C(=O)Nc2ccc(C)cc2C)=C(C)N=C2[NH+]=NNN21,C08592253_decoy,WEE1,Decoy,0.0,-7.78367,-4.89,-1.78,-5.476960182635648
O=C(CN1C(=O)N[C@@H](CC2=c3ccccc3=[NH+]C2)C1=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1,C63204481_decoy,WEE1,Decoy,0.0,-7.84536,-8.85,-3.69,-8.535026352031247
CC[C@@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CC2=c3ccccc3=[NH+][C@@H]2[C@H]2c3ccccc3C(=O)N21)[C@@H](C)CC,C63383661_decoy,WEE1,Decoy,0.0,-8.39403,-9.19,-2.05,-7.973970722937295
CC[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CC2=c3ccccc3=[NH+][C@@H]2[C@H]2c3ccccc3C(=O)N21,C63383778_decoy,WEE1,Decoy,0.0,-9.03446,-9.52,-3.03,-5.898147250648409
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C(=O)N1C1CCCCC1,C63472725_decoy,WEE1,Decoy,0.0,-8.86609,-6.52,-2.71,-5.874328683591268
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1C1CCCCC1,C63472946_decoy,WEE1,Decoy,0.0,-9.33343,-6.26,-2.09,-5.477361258030789
Cc1cc(Cl)cc2c1NC(=O)[C@]21N[C@H](CC2=c3ccccc3=[NH+]C2)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C63473004_decoy,WEE1,Decoy,0.0,-9.9356,-6.79,-1.56,-5.79739777600743
Cc1ccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C63479832_decoy,WEE1,Decoy,0.0,-9.26298,-6.91,-1.45,-5.496648552974849
Cc1ccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@@]4(C(=O)Nc5c(C)cccc54)[C@@H]3C2=O)cc1,C63479911_decoy,WEE1,Decoy,0.0,-9.7904,-6.52,-1.56,-5.834616989616306
Cc1cc(C)cc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(N[C@@H]3CC3=c4ccccc4=[NH+]C3)C(=O)Nc3ccccc32)c1,C63480108_decoy,WEE1,Decoy,0.0,-7.75685,-7.08,-1.67,-4.2848585176314415
CN(C)c1ccc([C@@H](CNC(=O)CN2C(=O)NC3(CCCC3)C2=O)C2=c3ccccc3=[NH+]C2)cc1,C63819103_decoy,WEE1,Decoy,0.0,-10.0445,-9.47,-2.74,-9.10107965288464
C=CCNc1nc2c(s1)C[C@]1(C)CC[C@@H]([C@H](C)C(=O)N3CC[NH+](C)CC3)[C@H](O)[C@H]1[C@@H]2C,C03840495_decoy,WEE1,Decoy,0.0,-9.92686,-6.91,-2.03,-6.934073524078389
C[C@H](C(=O)N1CCSCC1)[C@@H]1CC[C@@]2(C)Cc3sc(NC(=O)C[NH+](C)C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840960_decoy,WEE1,Decoy,0.0,-10.5612,-6.32,-2.87,-6.441599124188123
Cc1ccc2c(c1C)NC(=O)[C@@]21[NH2+][C@H](C(C)C)[C@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]21,C02229598_decoy,WEE1,Decoy,0.0,-6.64585,-5.67,-2.91,-3.949617282586367
C[C@@H](C(=O)Nc1ccc(Cl)cc1F)[NH+]1CCC(NS(=O)(=O)c2cccs2)CC1,C11719715_decoy,WEE1,Decoy,0.0,-8.64676,-8.3,-2.3,-7.680564913054514
Cc1ccc2c(c1C)NC(=O)[C@]21[NH2+][C@@H](C(C)C)[C@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]21,C02229602_decoy,WEE1,Decoy,0.0,-7.72075,-5.55,-3.75,-4.768073821415124
Cc1cc2c(cc1Cl)[C@H](O)CC1(CC[NH+](C[C@H](O)c3ccc4c(c3)OCCO4)CC1)O2,C19125705_decoy,WEE1,Decoy,0.0,-10.0164,-5.83,-2.48,-5.338931716872621
C[C@@H](C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)[NH+](C)Cc1ccc(OC(F)F)cc1,C20687752_decoy,WEE1,Decoy,0.0,-7.95109,-6.94,-3.4,-6.439168655966519
CC1(C)CC(NC(=S)N(Cc2ccc3c(c2)OCO3)C[C@H]2CCCO2)CC(C)(C)[NH2+]1,C21263310_decoy,WEE1,Decoy,0.0,-8.89767,-7.26,-4.96,-9.347466053715072
C[C@@H](c1ccc(S(C)(=O)=O)cc1)[NH+](C)Cc1nc(N)c2c3c(sc2n1)CCCCC3,C30004720_decoy,WEE1,Decoy,0.0,-8.59668,-8.94,-1.66,-12.22747069277793
Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)N3CCC[C@H](C)C3)ccc2N2CC[NH2+]CC2)cc1C,C33033596_decoy,WEE1,Decoy,0.0,-8.29518,-9.67,-2.09,-7.768605215768706
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)NCc2ccccc2)C2(CC[NH2+]CC2)C1,C39629787_decoy,WEE1,Decoy,0.0,-7.88,-6.19,-3.99,-5.161047046501734
Cc1cc(C(=O)N2C[C@H](C(=O)NC3CCCCCC3)C3(CC[NH2+]CC3)C2)n(C(C)(C)C)n1,C39633674_decoy,WEE1,Decoy,0.0,-8.67734,-4.91,-1.68,-6.1044397498569705
C[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCc2cccc(C(F)(F)F)c2)C2(CC[NH2+]CC2)C1,C39636788_decoy,WEE1,Decoy,0.0,-8.09414,-10.55,-3.69,-10.54035330037692
C[C@@H]1[C@@H](C)CCC[C@H]1NC(=O)[C@@H]1CN(C(=O)c2ccc3ccccc3n2)CC12CC[NH2+]CC2,C39637524_decoy,WEE1,Decoy,0.0,-7.86743,-8.29,-3.51,-6.452242899169034
O=C(NCCc1ccccc1F)[C@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39638850_decoy,WEE1,Decoy,0.0,-9.06348,-8.89,-2.53,-8.634203746870117
Cc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)[C@H](C)Oc3ccccc3)CC23CC[NH2+]CC3)cc1,C39639306_decoy,WEE1,Decoy,0.0,-9.59563,-9.43,-3.37,-11.65995529825432
CC[C@H](C(=O)N1C[C@@H](C(=O)N[C@@H](C#N)c2ccccc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39662452_decoy,WEE1,Decoy,0.0,-7.99054,-7.19,-4.18,-7.656722270870304
N#C[C@@H](NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)c1ccccc1,C39662568_decoy,WEE1,Decoy,0.0,-8.2345,-7.06,-3.34,-6.106769717517028
CCc1ccc(C(=O)N2C[C@H](C(=O)NC[C@H](C)Oc3ccccc3)C3(CC[NH2+]CC3)C2)cc1,C39665089_decoy,WEE1,Decoy,0.0,-9.21273,-8.39,-1.57,-8.281213910556119
Cc1ccc(C(=O)N2C[C@H](C(=O)NC[C@H](C)Oc3ccccc3)C3(CC[NH2+]CC3)C2)c(C)c1,C39665380_decoy,WEE1,Decoy,0.0,-8.66083,-9.53,-1.58,-9.37365598303656
Cc1ccc(CC(=O)N2C[C@@H](C(=O)NC[C@H](C)Oc3ccccc3)C3(CC[NH2+]CC3)C2)cc1,C39665456_decoy,WEE1,Decoy,0.0,-8.28397,-5.18,-4.99,-6.235238037835618
Cc1ccc(O[C@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccc(C)cc3)CC23CC[NH2+]CC3)cc1,C39665888_decoy,WEE1,Decoy,0.0,-7.99112,-8.86,-2.24,-7.810281685765558
Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)[C@H]3CC=CCC3)CC23CC[NH2+]CC3)cc1,C39666228_decoy,WEE1,Decoy,0.0,-9.02092,-5.43,-1.38,-6.271072011937267
CC1(C(=O)N2C[C@H](C(=O)NC[C@@H]3OCCc4ccccc43)C3(CC[NH2+]CC3)C2)CCCCC1,C39669022_decoy,WEE1,Decoy,0.0,-7.37939,-7.68,-1.83,-7.099116918940973
CCCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NC[C@H]2OCCc3ccccc32)C2(CC[NH2+]CC2)C1,C39669150_decoy,WEE1,Decoy,0.0,-10.2893,-8.75,-1.97,-9.484675115733989
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)C2(CC[NH2+]CC2)C1,C39672135_decoy,WEE1,Decoy,0.0,-8.8016,-9.28,-1.82,-10.550983536630154
CCC[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39673844_decoy,WEE1,Decoy,0.0,-9.13353,-5.9,-1.79,-6.575078341684947
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(C)c(F)c3F)CC23CC[NH2+]CC3)cc1,C39675345_decoy,WEE1,Decoy,0.0,-7.97092,-9.73,-2.81,-8.461966317847086
COc1ccccc1C(=O)N1C[C@@H](C(=O)NCCc2ccccc2Br)C2(CC[NH2+]CC2)C1,C39683654_decoy,WEE1,Decoy,0.0,-9.50463,-8.74,-3.65,-9.689475510330324
CC[C@H](C(=O)N1C[C@@H](C(=O)NCc2ccc(C#N)cc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39684891_decoy,WEE1,Decoy,0.0,-9.13866,-7.44,-2.76,-7.028346253334857
CC[C@@H](C(=O)N1C[C@@H](C(=O)NCc2ccc(C#N)cc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39684892_decoy,WEE1,Decoy,0.0,-9.44642,-9.37,-1.8,-10.06353369835964
N#Cc1ccc(CNC(=O)[C@@H]2CN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC23CC[NH2+]CC3)cc1,C39684955_decoy,WEE1,Decoy,0.0,-7.49447,-7.03,-3.47,-6.112985164122777
COc1ccccc1C[C@H](C)NC(=O)[C@@H]1CN(C(=O)Cc2ccc(C)cc2)CC12CC[NH2+]CC2,C39686751_decoy,WEE1,Decoy,0.0,-8.46807,-7.62,-3.01,-7.238413041355197
COc1ccccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)Cc2ccccc2C)CC12CC[NH2+]CC2,C39686754_decoy,WEE1,Decoy,0.0,-8.23587,-9.29,-1.93,-8.803656587512455
COc1ccccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)Cc2cccc(C)c2)CC12CC[NH2+]CC2,C39686758_decoy,WEE1,Decoy,0.0,-7.78428,-8.61,-1.92,-7.393783478932044
C[C@H](Cc1ccccc1F)NC(=O)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39686971_decoy,WEE1,Decoy,0.0,-8.80762,-6.62,-4.72,-4.214877992178582
COc1ccccc1C(=O)N1C[C@@H](C(=O)N[C@@H](C)Cc2ccc(F)cc2)C2(CC[NH2+]CC2)C1,C39688450_decoy,WEE1,Decoy,0.0,-8.38937,-4.83,-2.75,-4.968042887155293
COc1ccccc1C(=O)N1C[C@H](C(=O)N[C@H](C)Cc2ccc(F)cc2)C2(CC[NH2+]CC2)C1,C39688453_decoy,WEE1,Decoy,0.0,-8.27352,-9.23,-2.47,-9.929441584136418
Cc1cccc(CCNC(=O)[C@@H]2CN(C(=O)[C@H](C)Oc3ccccc3)CC23CC[NH2+]CC3)c1,C39689382_decoy,WEE1,Decoy,0.0,-7.97186,-10.07,-1.85,-9.97286586767234
C[C@@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)NCc2ccccc2Br)C2(CC[NH2+]CC2)C1,C39690580_decoy,WEE1,Decoy,0.0,-8.91387,-9.24,-2.65,-8.823710763368913
Cc1ccccc1CCNC(=O)[C@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2,C39691147_decoy,WEE1,Decoy,0.0,-7.48908,-10.37,-1.2,-8.724964240676764
C/C(=N\NC(=[NH2+])S[C@H]1CC(=O)N(c2ccc(Br)cc2)C1=O)c1ccccc1,C08397370_decoy,WEE1,Decoy,0.0,-8.54126,-7.37,-2.66,-6.937761585066638
CC(C)[NH+]1CCN(c2ccc(C(=O)NCC(=O)Nc3ccc(F)c(F)c3F)cc2)CC1,C60107790_decoy,WEE1,Decoy,0.0,-8.39573,-8.85,-0.47,-13.622065685756898
Cc1c(CNC(=O)C2=CNN3C2=[NH+][C@H](c2ccc(Br)cc2)C[C@@H]3C(F)(F)F)cnn1C,C12468353_decoy,WEE1,Decoy,0.0,-8.5673,-8.58,-0.59,-10.011821663238216
C/C(=N\NC(=[NH2+])S[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O)c1ccc(Cl)cc1,C16675637_decoy,WEE1,Decoy,0.0,-8.99846,-8.25,-2.96,-8.444198928845077
CC[NH+]1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1c1c([O-])[nH]c(=O)n(CCC2=CCCCC2)c1=O,C63384313_decoy,WEE1,Decoy,0.0,-9.11754,-10.22,-1.76,-12.820588272978762
CC(=O)Nc1ccc(S(=O)(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)c2cccs2)cc1,C63850106_decoy,WEE1,Decoy,0.0,-9.02398,-9.38,-2.67,-8.8719995935236
N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)Oc1ccc2c(c1)OC[C@H](c1ccccc1F)C2=O,C64428262_decoy,WEE1,Decoy,0.0,-8.69381,-9.83,-0.72,-8.05083240260268
COc1cc(OC)cc(C(=O)N2CC[C@]3(C2)NCc2ccccc2N/C3=[NH+]\C2CCCC2)c1,C65265899_decoy,WEE1,Decoy,0.0,-8.20304,-5.77,-3.11,-5.324678785288217
Cc1ccc(F)cc1S(=O)(=O)N1CC[C@@]2(C1)NCc1ccccc1N/C2=[NH+]\C(C)(C)C,C65266040_decoy,WEE1,Decoy,0.0,-7.60847,-6.4,-1.91,-6.093749636131228
CC[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2ccc(C(=O)OC)cc2)N3)C1,C04556313_decoy,WEE1,Decoy,0.0,-9.41153,-4.44,-0.36,-4.805684044741566
Cc1cc(C(F)(F)F)nn1CC(=O)NN=C1CC(C)(C)[NH2+]C(C)(C)C1,C06787368_decoy,WEE1,Decoy,0.0,-6.44016,-8.29,-4.15,-7.283521858217845
COc1ccc(C2(O)CC[NH+](C[C@@H](O)c3ccc4c(c3)OCCO4)CC2)cc1,C12292119_decoy,WEE1,Decoy,0.0,-9.11808,-8.55,-1.98,-7.910668497731306
O[C@@H]1CC2(CC[NH+](C[C@H](O)c3ccc4c(c3)OCCO4)CC2)Oc2ccc(F)cc21,C12293395_decoy,WEE1,Decoy,0.0,-8.78038,-7.68,-1.23,-6.329097091172391
Cc1cccc(N2CCN(C(=O)C[NH+]3Cc4ccccc4C[C@H]3C(N)=O)CC2)c1,C29050898_decoy,WEE1,Decoy,0.0,-8.67331,-7.65,-3.36,-6.086832188606825
O=C(CNC(=O)c1coc([C@@H]2CCC[NH2+]2)n1)c1ccc(Br)cc1,C33635875_decoy,WEE1,Decoy,0.0,-7.86096,-8.21,-0.6,-7.323807123552483
CNC(=O)c1ccc([C@H]2CCCN2c2cc(C3CC[NH2+]CC3)ncn2)s1,C39516230_decoy,WEE1,Decoy,0.0,-9.11052,-8.81,-1.7,-9.394358269683655
Cc1ccc([C@H](C)NC(=O)[C@@H]2CN(C(=O)C3CCOCC3)CC23CC[NH2+]CC3)cc1,C39639445_decoy,WEE1,Decoy,0.0,-8.23042,-6.84,-4.45,-6.500125976631411
CC(C)C(=O)N1C[C@@H](C(=O)NC[C@@H]2OCCc3ccccc32)C2(CC[NH2+]CC2)C1,C39668863_decoy,WEE1,Decoy,0.0,-7.81743,-5.58,-2.12,-5.520983747064226
O=C(NCCc1ccco1)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39671054_decoy,WEE1,Decoy,0.0,-8.86434,-8.03,-2.12,-7.9821334318752175
C[C@@H](NC(=O)[C@H]1CN(C(=O)c2cccn2C)CC12CC[NH2+]CC2)C(C)(C)C,C39684530_decoy,WEE1,Decoy,0.0,-7.89567,-5.35,-2.64,-4.564563365147376
C[C@H](NC(=O)[C@H]1CN(C(=O)C2CCOCC2)CC12CC[NH2+]CC2)C(C)(C)C,C39684733_decoy,WEE1,Decoy,0.0,-8.25373,-5.09,-3.07,-5.178336678693145
C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)Nc3nncs3)cc2)C1,C47498103_decoy,WEE1,Decoy,0.0,-8.3577,-7.38,-1.66,-6.747079519396884
Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)NC1CC[NH+](C)CC1,C48099894_decoy,WEE1,Decoy,0.0,-8.29059,-7.55,-2.68,-6.664802781521465
Cc1nn(C[NH+]2CCC(NC(=O)NC3CCCCC3)CC2)c(=S)s1,C48340435_decoy,WEE1,Decoy,0.0,-9.31709,-5.59,-1.62,-7.592783573088164
Cc1ncsc1C(=O)NC1CC[NH+](CC(=O)NC2CCC(C)CC2)CC1,C51100254_decoy,WEE1,Decoy,0.0,-7.83206,-4.94,-0.84,-4.279816461164391
Cc1cc(N2CCSCC2)ccc1NC(=O)NCc1cc[nH+]c(N(C)C)c1,C51673307_decoy,WEE1,Decoy,0.0,-8.10768,-9.05,-1.36,-11.170913594290472
CC(C)C(=O)N1CCC(NC(=O)NC[C@]2([NH+](C)C)CCC[C@@H](C)C2)CC1,C52522886_decoy,WEE1,Decoy,0.0,-7.69565,-8.3,-3.81,-4.266719510469801
NC(=O)c1ccc(-c2nc(CN3CCN(c4cccc[nH+]4)CC3)cs2)cc1,C53602520_decoy,WEE1,Decoy,0.0,-9.38997,-6.21,-2.06,-5.984064758842909
O=C(C[NH+]1CCC[C@H](O)C1)NC1(c2ccc3c(c2)OCCO3)CCCC1,C53778479_decoy,WEE1,Decoy,0.0,-8.1892,-8.03,-0.86,-8.838244332318288
C[C@H](c1ccccc1)[NH+]1CC[C@H](NC(=O)C(=O)Nc2cccc3cccnc23)C1,C54939202_decoy,WEE1,Decoy,0.0,-8.23835,-8.09,-3.35,-6.806371145936794
Cc1[nH]c2ccc(C(=O)Nc3ccc(C(=O)N4CC[NH+](C)CC4)cc3)cc2c1C,C56299332_decoy,WEE1,Decoy,0.0,-7.65631,-10.57,-1.04,-14.26277095958335
NC(=O)CC1CC[NH+](Cc2nc(-c3cc(Br)cs3)no2)CC1,C56494251_decoy,WEE1,Decoy,0.0,-9.30153,-8.06,-2.02,-7.863415562109925
C[C@H](NC(=O)N1CCC(CO)CC1)c1ccc(N2CC[NH+](C)CC2)cc1,C56899395_decoy,WEE1,Decoy,0.0,-7.5877,-8.26,-1.1,-12.247118827127077
C#CCNC(=O)C[NH+]1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1,C54211480_decoy,WEE1,Decoy,0.0,-7.71559,-4.34,-1.57,-4.82253873220342
O=C(C[NH+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1)N[C@@H]1CCS(=O)(=O)C1,C59403776_decoy,WEE1,Decoy,0.0,-8.49966,-5.67,-2.5,-4.1001630605791295
Cc1sc2nc(C[NH+]3CCCC3)nc(N3C[C@H](C(N)=O)CC[C@@H]3C)c2c1C,C60446760_decoy,WEE1,Decoy,0.0,-8.52395,-8.63,-1.22,-9.502240061254248
O=C(NCC(=O)N1CCC[NH+](C2CC2)CC1)Nc1ccc(Br)cc1,C61603837_decoy,WEE1,Decoy,0.0,-6.4538,-7.56,-2.66,-5.822841490167634
Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc(N2CCC(C)CC2)[nH+]c1,C62061085_decoy,WEE1,Decoy,0.0,-7.54714,-8.21,-0.42,-10.090262561266917
Cc1cc([C@@H](C)NC(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)c(C)o1,C62648116_decoy,WEE1,Decoy,0.0,-8.29629,-9.01,-1.92,-7.167159385849839
C/C(=N\[NH+]=C(/N)S[C@H]1CC(=O)N(c2ccccc2)C1=O)c1cccs1,C13154799_decoy,WEE1,Decoy,0.0,-8.10424,-7.14,-0.87,-6.998898981922294
Cc1ccc(C2=[NH+][C@@H](c3sc(NC(=O)CC(C)C)nc3C)ON2)cc1,C53619969_decoy,WEE1,Decoy,0.0,-8.31676,-8.07,-2.96,-9.169836097645891
CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)C2=c3ccccc3=[NH+][C@H]2C)c1,C63405723_decoy,WEE1,Decoy,0.0,-7.71029,-10.0,-2.47,-8.284681565939968
O=C(NCCC1=c2ccccc2=[NH+]C1)N[C@H]1CC(=O)N(c2ccc(F)cc2)C1,C63681148_decoy,WEE1,Decoy,0.0,-8.21806,-6.87,-1.9,-5.32141823132091
O=C(CC1=c2ccccc2=[NH+]C1)NNC(=O)C1=CC[C@H](Br)O1,C63842496_decoy,WEE1,Decoy,0.0,-7.89057,-8.35,-2.24,-7.684642468452934
CC(C)[NH+]1CCC(N[C@H]2CCCc3nc(N4CCC(CO)CC4)ncc32)CC1,C20600075_decoy,WEE1,Decoy,0.0,-9.74627,-7.87,-0.75,-7.89522123673393
CC1=NN2[C@@H](N[C@@H](C)[C@@H]2CNC(=O)CCC2=c3ccccc3=[NH+]C2)S1,C65216921_decoy,WEE1,Decoy,0.0,-8.70699,-8.74,-1.81,-7.671309520883372
Cc1cc(C)c(NC(=O)C[NH+]2CCC(NC(=O)c3ccc(C)o3)CC2)c(C)c1,C51097582_decoy,WEE1,Decoy,0.0,-7.60738,-7.56,-2.92,-7.229138350961478
Cc1nc([C@H](C)[NH+]2CN[C@H](c3ccccc3)[C@@H]2c2ccc3occc3c2)n[nH]1,C65421334_decoy,WEE1,Decoy,0.0,-8.01618,-6.22,-1.58,-4.945736882801019
CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CC[C@@H]([NH+]3CCCC3)C2)cc1,C66160781_decoy,WEE1,Decoy,0.0,-8.17998,-9.23,-1.14,-7.754397150840582
CC[NH+](CC)C1CCN(C(=O)c2sc(S(N)(=O)=O)cc2C)CC1,C66395275_decoy,WEE1,Decoy,0.0,-8.99275,-6.91,-2.06,-9.604855064269811
C[C@@H](NC(=O)NCc1cccnc1N1CC[NH+](C)CC1)c1ccc(F)cc1,C66888435_decoy,WEE1,Decoy,0.0,-7.59869,-8.93,-4.49,-7.391861534904389
Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(NC(=O)c3ccoc3C)CC2)c(C)c1,C66890907_decoy,WEE1,Decoy,0.0,-7.06689,-5.17,-3.2,-4.048708516647896
Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(NC(=O)c3ccoc3C)CC2)c(C)c1,C66890909_decoy,WEE1,Decoy,0.0,-6.94852,-9.55,-3.36,-8.229408023784782
CC(=O)Nc1cc(NC(=O)N2CCC([NH+]3CCCC3)CC2)c(F)cc1F,C66981386_decoy,WEE1,Decoy,0.0,-7.98548,-9.01,-2.04,-5.1910616995730345
Cc1cc(S(N)(=O)=O)sc1C(=O)N1C[C@@H]([NH+](C)C)Cc2ccccc21,C67339785_decoy,WEE1,Decoy,0.0,-6.93978,-9.72,-0.97,-8.798326700090376
C[C@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccc(N2CC[NH+](C)CC2)cc1,C67426703_decoy,WEE1,Decoy,0.0,-8.77931,-8.52,-0.82,-8.893301877371957
O=C(NC1(c2cc(F)cc(F)c2)CC1)c1cn(C[C@H]2CCC[NH2+]C2)nn1,C67447321_decoy,WEE1,Decoy,0.0,-8.45142,-8.19,-1.52,-7.554529864912846
Cc1cc([C@H](C)NC(=O)Nc2ccc(N3CC[NH+](C)CC3)cc2C)c(C)o1,C67527859_decoy,WEE1,Decoy,0.0,-8.25213,-8.97,-0.37,-7.679457487563972
O=C(Nc1nnc(C(F)F)s1)NC1CC[NH+](Cc2ccc(F)cc2)CC1,C67587174_decoy,WEE1,Decoy,0.0,-7.13429,-9.05,-1.52,-7.233044765336785
O=C(C[C@H]1Sc2ccccc2NC1=O)N/N=C/c1ccccc1[N+](=O)[O-],C04606677_decoy,WEE1,Decoy,0.0,-5.66831,-5.34,-0.43,-4.08554611901716
C[C@H](O)CN(C[C@@H](C)O)c1ncnc2c1oc1nc3c(cc12)COC(C)(C)C3,C02236928_decoy,WEE1,Decoy,0.0,-8.81275,-8.28,-0.87,-8.336312581420456
C[C@@H]1CCO[P@](=O)([C@H](Nc2ccc(O)cc2)c2ccc([N+](=O)[O-])cc2)O1,C04063481_decoy,WEE1,Decoy,0.0,-6.95027,-6.41,-0.67,-6.063204692762504
COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1cccc([N+](=O)[O-])c1,C04697941_decoy,WEE1,Decoy,0.0,-6.90023,-9.76,0.18,-8.877787691741611
COC(=O)Cn1/c(=N/C(=O)C(C)C)sc2cc(S(N)(=O)=O)ccc21,C04233954_decoy,WEE1,Decoy,0.0,-9.34269,-5.61,-1.75,-7.114135280867407
O=C(NNS(=O)(=O)c1ccc(F)c(F)c1F)c1cccc([N+](=O)[O-])c1,C07386210_decoy,WEE1,Decoy,0.0,-6.55017,-5.13,-1.85,-4.937805967921944
Cc1onc(-c2ccccc2)c1-c1nnc(CSc2nnc(N)s2)o1,C08311915_decoy,WEE1,Decoy,0.0,-9.21306,-8.61,-1.49,-9.15231838380035
CCOC(=O)NC(=O)c1c(NC(=O)c2ccno2)sc2c1CC[C@H](C)C2,C09704406_decoy,WEE1,Decoy,0.0,-7.98721,-6.46,-0.49,-7.584469593091062
Cc1nc(SCC(=O)NN2C(=O)NC3(CCCCC3)C2=O)c(C#N)c(C)c1C,C05172511_decoy,WEE1,Decoy,0.0,-7.67479,-9.09,-3.29,-7.181628371068708
CC(C)(C)OC(=O)N1CCc2[nH]/c(=N/C(=O)c3ccc(=O)[nH]c3)sc2C1,C22528120_decoy,WEE1,Decoy,0.0,-6.99446,-8.86,-0.43,-14.318146197594002
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1cccc(N3CCCC3=O)c1)C2=O,C24769769_decoy,WEE1,Decoy,0.0,-7.94702,-9.43,-1.59,-7.922093624569627
NC(=O)c1ccc(CN2CCC[C@H](c3nc4ccccc4o3)C2)c([N+](=O)[O-])c1,C29827803_decoy,WEE1,Decoy,0.0,-7.25815,-5.51,-1.6,-4.195975012422179
CCNc1nc2c(s1)[C@H](c1cc3c(c(OC)c1OC)OCO3)CC(=O)N2,C35324910_decoy,WEE1,Decoy,0.0,-8.68465,-7.97,-2.37,-7.779886473425988
CC(C)[C@@H](NC(=O)Nc1ccc(-n2cncn2)cc1)c1ccc2c(c1)OCCO2,C44040075_decoy,WEE1,Decoy,0.0,-8.41089,-9.32,-1.9,-9.260191538246492
CCCc1nnc(NC(=O)N2CCC[C@@H](C(=O)Nc3ncccc3C)C2)s1,C47378519_decoy,WEE1,Decoy,0.0,-6.57873,-5.79,-3.41,-5.784650306832948
O=C(CCSc1nc(Cl)nc2nc[nH]c12)Nc1ccc2c(c1)OCO2,C13551248_decoy,WEE1,Decoy,0.0,-8.15676,-8.3,-2.45,-8.839480681775884
Cc1cc(C)cc(N2CC[C@@H](C(=O)NNC(=O)c3ccc4c(c3)OCO4)C2=O)c1,C53086030_decoy,WEE1,Decoy,0.0,-7.78017,-9.14,-1.96,-7.828854194142524
O=C(CN1C(=O)N[C@@]2(CCSC2)C1=O)Nc1ccnn1CC1CCCCC1,C53241253_decoy,WEE1,Decoy,0.0,-7.73938,-7.51,-0.41,-7.109341386338016
C=C1C=C([O-])N2C(=NC(N3CCN(c4ccccc4)CC3)=[NH+][C@H]2c2cccnc2)N1,C54278072_decoy,WEE1,Decoy,0.0,-7.41559,-9.02,-1.4,-12.800272042082858
Cc1ccc(NC(=O)C2CCN(C(=O)Nc3cccc4c3OCCO4)CC2)nc1,C56719765_decoy,WEE1,Decoy,0.0,-7.68664,-9.19,-2.17,-6.851190898278419
CC(C)(C)c1nnc(NC(=O)N2CCC[C@H](C(=O)Nc3nccs3)C2)s1,C56736381_decoy,WEE1,Decoy,0.0,-9.43484,-5.02,-3.65,-5.231215814332677
CC(=O)Nc1cccc(NC(=O)c2nnn(-c3nc4c(s3)CCCC4)c2C)c1,C56933984_decoy,WEE1,Decoy,0.0,-9.38613,-8.6,-1.17,-14.176743143731423
CNC(=O)NC(=O)[C@@H](C)Sc1nnc(N2CCCC2)n1-c1ccc(C)cc1,C07256781_decoy,WEE1,Decoy,0.0,-8.37177,-7.94,-2.16,-14.98689698082338
Cc1cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])s2)c(C)n1-c1ccccc1,C15835556_decoy,WEE1,Decoy,0.0,-7.95797,-9.83,-1.2,-8.533182872720204
Cc1ccc(-c2nnco2)cc1NC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1,C59006649_decoy,WEE1,Decoy,0.0,-8.359,-9.36,-1.83,-9.073017761827428
CNc1nc(N/N=C/c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)ncc1F,C59640560_decoy,WEE1,Decoy,0.0,-7.91283,-8.96,-0.97,-7.427082493035052
O=C(Nc1ccccc1-n1cnnn1)c1cccc(NC(=O)c2cccs2)c1,C60775132_decoy,WEE1,Decoy,0.0,-7.85341,-10.46,-2.9,-9.02684321384991
O=C(NCc1ccccc1-n1cccn1)Nc1nnc(-c2ccccn2)s1,C62648944_decoy,WEE1,Decoy,0.0,-6.38847,-7.64,-0.17,-6.164919363462845
CNC(=O)C1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1,C63260491_decoy,WEE1,Decoy,0.0,-7.72512,-8.67,-3.73,-10.048940818835996
Cc1nc2ccccc2n1NC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1,C63477697_decoy,WEE1,Decoy,0.0,-7.85566,-8.39,-2.11,-8.725106277207155
COc1cc([C@@H]2C(C#N)=C(N)OC3=NN=C(C(F)(F)F)[C@H]32)cc(OC)c1OC,C01062035_decoy,WEE1,Decoy,0.0,-6.2153,-8.45,-1.14,-7.44808719370356
Cc1cc(Oc2ncccn2)ccc1NC(=O)N1CCC(C(=O)NC2CC2)CC1,C65481675_decoy,WEE1,Decoy,0.0,-8.18399,-7.05,-1.86,-6.141159429054493
C[C@@H](NC(=O)N[C@H]1CCCN(c2ncccn2)C1)c1ccc2c(c1)OCO2,C45403713_decoy,WEE1,Decoy,0.0,-7.99102,-8.91,-1.42,-7.663344682697208
C[C@H](NC(=O)Nc1ccc(-n2cccn2)nc1)c1ccc(N2CCCC2=O)cc1,C65993698_decoy,WEE1,Decoy,0.0,-7.38497,-9.0,-3.4,-6.441957471598245
O=C(c1cc(S(=O)(=O)Nc2ccnn2C2CCCCC2)c[nH]1)N1CCCC1,C66248301_decoy,WEE1,Decoy,0.0,-8.77502,-7.37,-1.89,-8.739950856045228
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O,C25224295_decoy,WEE1,Decoy,0.0,-6.5978,-9.79,-2.03,-6.653121083996242
C[C@@H](c1cccs1)N(C)C(=O)NNC(=O)c1nnc(-c2ccccc2)o1,C66385436_decoy,WEE1,Decoy,0.0,-7.47919,-8.29,-0.74,-8.221043392929488
Cc1cccc(C(=O)NNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c1,C66558653_decoy,WEE1,Decoy,0.0,-6.86838,-9.32,-0.85,-8.87830896444275
COC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1,C66644340_decoy,WEE1,Decoy,0.0,-7.49424,-8.16,-2.54,-6.88983291319455
COC(=O)N1CCC[C@H]1C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1,C66644341_decoy,WEE1,Decoy,0.0,-7.65439,-5.28,-1.11,-4.296574035672958
O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1cnc2c(cnn2C2CCCC2)c1,C66789437_decoy,WEE1,Decoy,0.0,-8.95661,-9.74,-1.13,-7.897296712571616
O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1cc(-c2ccco2)[nH]n1,C66856611_decoy,WEE1,Decoy,0.0,-8.12928,-10.14,-3.44,-7.633523792434481
C[C@@H](NC(=O)N1CCC(NC(=O)CC2CCCCC2)CC1)c1nncn1C,C66926712_decoy,WEE1,Decoy,0.0,-8.157,-6.97,-2.52,-4.635986215484553
O=C(CC1CCCC1)NC1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1,C66928505_decoy,WEE1,Decoy,0.0,-8.0847,-8.87,-5.69,-7.389109098750796
CN(C(=O)C(=O)NC[C@]1(O)CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1,C67000228_decoy,WEE1,Decoy,0.0,-7.51028,-8.24,-1.09,-7.422835870043595
CC(C)c1nc(CC(=O)NC2CCN(c3ncnc4[nH]cnc34)CC2)cs1,C67049712_decoy,WEE1,Decoy,0.0,-8.89659,-7.4,-1.61,-7.859186640748427
O=C(CNC(=O)N1CCC[C@H]1c1cccc2c1OCCO2)NCc1ccco1,C67064052_decoy,WEE1,Decoy,0.0,-7.63787,-8.76,-0.93,-8.266652127726223
Cc1c(C(=O)Oc2cccc(C(N)=O)c2)nnn1-c1cccc2cccnc12,C67165424_decoy,WEE1,Decoy,0.0,-7.95773,-9.68,-1.24,-7.924276273120027
CNS(=O)(=O)c1ccc(C(=O)Nc2nc(-c3ccc(C)s3)ns2)o1,C67174443_decoy,WEE1,Decoy,0.0,-10.0226,-8.38,-0.21,-8.357847071124441
COC(=O)Nc1ccc(NC(=O)N2CCCN(C(=O)C(C)(C)C)CC2)cc1,C67263921_decoy,WEE1,Decoy,0.0,-6.16246,-4.67,-3.21,-4.113127046510747
COC(=O)NC(=O)c1c(NC(=O)c2ccc3c(c2)OCCO3)sc2c1CCCC2,C05145747_decoy,WEE1,Decoy,0.0,-9.74479,-10.37,-2.12,-10.202320616911926
Cc1ccc(S(=O)(=O)NC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1,C05602660_decoy,WEE1,Decoy,0.0,-7.96738,-9.07,-3.51,-6.850508996525796
CS(=O)(=O)N[C@H]1CO[C@H]2[C@@H]1OC[C@H]2OC(=O)Nc1cccc2ccccc12,C04235451_decoy,WEE1,Decoy,0.0,-6.80304,-8.57,-1.38,-7.8079374731448175
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3cncn3-c3ccc(F)cc3)cc2)n1,C06510750_decoy,WEE1,Decoy,0.0,-7.56112,-9.43,-2.68,-7.131463474011321
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)N(C)[C@H]3CCS(=O)(=O)C3)n2N)cc1,C07298559_decoy,WEE1,Decoy,0.0,-7.33555,-7.76,-1.19,-6.271530863970872
O=C(NN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)c1ccc2c(c1)OCO2,C08132043_decoy,WEE1,Decoy,0.0,-6.78214,-9.23,-1.87,-6.296688993270704
O=C(Nc1ccc(-n2cnnn2)cc1)c1cccc(NC(=O)c2cccs2)c1,C08231517_decoy,WEE1,Decoy,0.0,-8.3842,-9.13,-1.0,-19.57790525046268
O=C(Nc1nc2c(s1)CC[C@H]2C(=O)NC[C@H]1CCCO1)c1ccc2c(c1)OCO2,C09132450_decoy,WEE1,Decoy,0.0,-9.81368,-9.11,-0.85,-7.934948471401345
O=C(Nc1nc2c(s1)CC[C@@H]2C(=O)NCc1cccnc1)c1ccc2c(c1)OCO2,C08979813_decoy,WEE1,Decoy,0.0,-8.04004,-6.08,-1.16,-5.09547217483913
Cc1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)CC2)nc1,C09407261_decoy,WEE1,Decoy,0.0,-7.06381,-5.79,-3.21,-4.240431871624515
Cc1ccccc1-n1c(C)nnc1SCC(=O)N1C[C@H](C(N)=O)Oc2ccccc21,C10348987_decoy,WEE1,Decoy,0.0,-7.1891,-8.22,-1.98,-6.73404526069769
Cc1cc(NC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)ccc1N1CCCC1=O,C11486634_decoy,WEE1,Decoy,0.0,-8.99999,-9.59,-1.15,-8.19757116841027
COc1ccccc1NC(=O)Nc1ccnn1C1CCN(C(=O)c2ccsc2)CC1,C15073494_decoy,WEE1,Decoy,0.0,-8.40674,-5.56,-2.47,-5.916842469677362
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3)c2)C[C@H](C)O1,C15435512_decoy,WEE1,Decoy,0.0,-7.91866,-9.41,-1.9,-8.473979943865421
COc1ccc(NC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)cc1,C20799769_decoy,WEE1,Decoy,0.0,-7.96242,-5.86,-2.23,-5.1949153250657805
Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C(=O)Nc1ccc(N(C)C)cc1,C20800105_decoy,WEE1,Decoy,0.0,-8.83597,-7.09,-3.01,-6.905299828699483
Cc1ccc(-n2nnnc2S[C@@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c(C)c1,C21565977_decoy,WEE1,Decoy,0.0,-7.99187,-8.25,-3.84,-8.109068483737031
O=C(Nc1nccs1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1,C06146821_decoy,WEE1,Decoy,0.0,-9.09799,-9.73,-1.67,-7.152912517419732
Cc1cc(C(=O)NNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)c(C)o1,C25953209_decoy,WEE1,Decoy,0.0,-7.62216,-9.51,-3.76,-7.890702118594324
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1,C32801666_decoy,WEE1,Decoy,0.0,-7.83677,-5.33,-1.66,-5.721259197630016
CC(=O)Nc1cc(C)nn1-c1ccc(NC(=O)c2ccc(-n3cccn3)cc2)cc1,C32832437_decoy,WEE1,Decoy,0.0,-7.26301,-7.11,-1.68,-5.47586983862442
Cc1cc2c(cc1S(=O)(=O)N1CCC(C(=O)NC(C)(C)C)CC1)O[C@@H](C)C(=O)N2,C32958862_decoy,WEE1,Decoy,0.0,-8.3912,-8.74,-1.03,-12.98078173225466
CCN1C(=O)c2cc(C(=O)NC3CCCC3)nn2C[C@]1(C)C(=O)NC1CCCC1,C33249943_decoy,WEE1,Decoy,0.0,-7.79728,-6.99,-1.82,-7.652719062318477
CC(=O)N[C@H]1[C@@H](OC(=O)c2ccccc2)[C@@H]2O[C@H](c3ccccc3)OC[C@H]2O[C@H]1O,C35636093_decoy,WEE1,Decoy,0.0,-6.23107,-8.88,-2.65,-7.061443978087579
N#C/C(=C\c1c(N2CCN(c3ccccc3)CC2)nc2ccccn2c1=O)C(N)=O,C02201806_decoy,WEE1,Decoy,0.0,-8.19667,-5.81,-1.34,-5.128569847329145
O=[P@@]1([O-])N[NH+]2C[C@@H]3C=C(F)C(S(=O)(=O)Oc4ccccc4)=C[C@H]3C[C@H]2CO1,C39469265_decoy,WEE1,Decoy,0.0,-8.0844,-9.1,-1.88,-6.729231088422553
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)Nc1ccc(C(=O)N(C)C)cc1)C2=O,C36694750_decoy,WEE1,Decoy,0.0,-7.76138,-8.48,-0.32,-7.284322651482595
CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)N[C@H]1CCS(=O)(=O)C1)C2=O,C39544402_decoy,WEE1,Decoy,0.0,-7.69975,-7.16,-1.87,-7.926986903614651
CC(=O)N[C@@H]1[C@@H](OC(=O)c2ccccc2)[C@@H]2O[C@@H](c3ccccc3)OC[C@H]2O[C@H]1O,C44018966_decoy,WEE1,Decoy,0.0,-6.03943,-9.51,-2.85,-9.067812845647111
C[C@H]1CCc2sc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)cc2C1,C46642949_decoy,WEE1,Decoy,0.0,-9.10238,-9.21,-1.22,-8.092952186430987
Cc1c(C(=O)NNC(=O)C2CCN(C(=O)c3ccco3)CC2)oc2ccccc12,C17449114_decoy,WEE1,Decoy,0.0,-7.49325,-10.28,-2.66,-8.842997609137477
[H]/N=C1\S[C@H](C(=O)Nc2ccccc2)CC(=O)N1/N=C/c1ccc2c(c1)OCO2,C58836520_decoy,WEE1,Decoy,0.0,-7.93782,-6.2,-1.18,-4.3217027408592745
COC1=CC=C2N=C(C(=O)NCC(=O)/N=c3\[nH]c4ccccc4s3)C[C@@H]2[C@H]1OC,C39984442_decoy,WEE1,Decoy,0.0,-9.31733,-9.25,-1.93,-10.192222935527724
CC1=C2[C@H](c3cccc(C(F)(F)F)c3)CC(=O)N[C@@H]2N(C2=NC=NC3=NC=N[C@@H]32)N1,C38598972_decoy,WEE1,Decoy,0.0,-7.30213,-8.3,-3.97,-6.291775541371769
O=C(NCC(=O)N1CCC[C@@H]1c1nnc2n1CCCCC2)NCC1CCCC1,C50558826_decoy,WEE1,Decoy,0.0,-8.46316,-8.64,-1.7,-11.598160107317304
COC(=O)CC1=NN=C2OC(N)=C(C#N)[C@H](c3cncc(-c4ccc(F)cc4)c3)[C@H]12,C01423957_decoy,WEE1,Decoy,0.0,-7.45961,-5.32,-0.43,-4.588349048839195
CC(=O)N[C@@H]1[C@H](OC(=O)c2ccccc2)[C@H]2O[C@@H](c3ccccc3)OC[C@H]2O[C@@H]1O,C65733854_decoy,WEE1,Decoy,0.0,-6.38028,-4.91,-1.95,-5.268576327641854
CC(=O)N[C@H]1[C@@H](OC(=O)c2ccccc2)[C@H]2O[C@@H](c3ccccc3)OC[C@H]2O[C@@H]1O,C65733858_decoy,WEE1,Decoy,0.0,-4.90146,-4.72,-2.18,-3.9411527161333098
O=C(Nc1cccnc1-n1cncn1)N[C@H](c1ccc(F)cc1)c1ccccn1,C66671379_decoy,WEE1,Decoy,0.0,-8.06362,-7.79,-3.23,-7.877579178597908
Cc1cc([C@H]2CCCN2C(=O)C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)no1,C66720122_decoy,WEE1,Decoy,0.0,-7.94787,-7.22,-4.72,-6.167588964961842
Cc1cc([C@@H]2CCCN2C(=O)C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)no1,C66720125_decoy,WEE1,Decoy,0.0,-7.48637,-6.61,-4.19,-6.098095909630499
C[C@H](NC(=O)C1CCOCC1)C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1,C66856545_decoy,WEE1,Decoy,0.0,-8.10153,-9.56,-1.09,-8.321216744348837
COC(=O)c1cc(-c2csc(NC(=O)c3ccc4c(c3)OCCCO4)n2)c[nH]1,C30986470_decoy,WEE1,Decoy,0.0,-8.54011,-8.16,-0.6,-6.678421334762573
Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)NCc1nc(C2CC2)no1,C66967541_decoy,WEE1,Decoy,0.0,-8.92762,-8.08,-0.86,-13.550294628748718
Cn1c(CCNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)n[nH]c1=S,C67052042_decoy,WEE1,Decoy,0.0,-9.30157,-9.09,-0.89,-8.145379463882003
C[C@H](NC(=O)N1CCC[C@@H]1c1cccc2c1OCCO2)C(=O)NCc1ccco1,C67081126_decoy,WEE1,Decoy,0.0,-7.78998,-7.82,-3.97,-8.756941847829648
Cc1occc1C(=O)N1CCN(C(=O)NNC(=O)CCC2CCCCC2)CC1,C67101733_decoy,WEE1,Decoy,0.0,-8.33767,-5.67,-2.25,-5.44093247223244
C[C@H](NC(=O)Nc1cccc(S(=O)(=O)C(F)F)c1)c1nnc2ccccn12,C67317125_decoy,WEE1,Decoy,0.0,-8.17357,-8.9,-2.3,-8.624101969019137
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3nnc(C(F)F)s3)C2=O)cc1,C67524482_decoy,WEE1,Decoy,0.0,-8.25871,-8.94,-1.52,-6.94034368004628
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Nc2nnc(C(F)F)s2)cc1,C67587137_decoy,WEE1,Decoy,0.0,-7.23973,-5.77,-2.41,-4.950282099624842
Nc1c(-c2nc(-c3ccncc3)no2)nnn1-c1ccccc1C(F)(F)F,C04316750_decoy,WEE1,Decoy,0.0,-7.76465,-9.23,-1.06,-8.131197384165716
COC(=O)NC(=O)c1c(NC(=O)C2=COCCO2)sc2c1CCCCC2,C05146069_decoy,WEE1,Decoy,0.0,-8.26949,-7.89,-4.03,-9.62799965968564
O=C(NN1C(=O)c2ccccc2N[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1,C05800172_decoy,WEE1,Decoy,0.0,-6.77228,-5.38,-2.26,-4.043482505579582
CC1=NN(C(=O)c2cc(-c3ccc4c(c3)OCO4)[nH]n2)[C@](O)(C(F)F)C1,C06394712_decoy,WEE1,Decoy,0.0,-7.28304,-10.14,0.22,-7.960775606555584
O=C(NNC(=O)C1CCN(c2nc3ccccc3o2)CC1)c1ccco1,C12941652_decoy,WEE1,Decoy,0.0,-7.45461,-9.6,-1.92,-7.53987220640529
CNC(=O)[C@H]1CN(CC(=O)Nc2cccc3nsnc23)c2ccccc2O1,C19095501_decoy,WEE1,Decoy,0.0,-8.83156,-9.08,-1.96,-8.310978898318181
COc1cc2c(cc1OC)[C@@H](c1c([O-])nc(SC)n(C(C)=O)c1=O)[NH2+]CC2,C19703057_decoy,WEE1,Decoy,0.0,-4.50481,-5.3,-1.61,-3.323141039347356
Cc1cc2c(cc1S(=O)(=O)Nc1ccc3c(c1)OCO3)OCC(=O)N2,C21108414_decoy,WEE1,Decoy,0.0,-7.37119,-9.41,-0.29,-7.107930284665114
Cc1ccc(N2C[C@H](C(=O)NN3C(=O)NC4(CCCCC4)C3=O)CC2=O)cc1,C24578354_decoy,WEE1,Decoy,0.0,-7.335,-6.45,-1.36,-4.551937836477115
Cc1c(Cl)cc(S(=O)(=O)N2CCC(C(N)=O)CC2)cc1[N+](=O)[O-],C32738597_decoy,WEE1,Decoy,0.0,-7.40177,-8.1,-1.46,-11.329404410195846
Nc1ncncc1-c1noc([C@@H]2CCCN2Cc2cc3ccccc3o2)n1,C35426062_decoy,WEE1,Decoy,0.0,-8.33787,-8.69,-0.97,-10.12241281467258
CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc([N+](=O)[O-])cc3)[C@@H]2C1,C04730281_decoy,WEE1,Decoy,0.0,-6.43808,-4.34,0.45,-3.4658517729437244
O=C(CSc1nc(Cl)nc2nc[nH]c12)Nc1ccc2c(c1)OCO2,C08991889_decoy,WEE1,Decoy,0.0,-7.86166,-8.69,-0.5,-9.01477359357445
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1Cc2ccccc2C[C@H]1C(N)=O,C36760997_decoy,WEE1,Decoy,0.0,-7.01891,-4.71,-1.23,-4.181607066206609
O[C@]1(c2ccc3c(c2)OCO3)OC[C@H]2[C@H](c3ccc4c(c3)OCO4)OC[C@]21O,C13372046_decoy,WEE1,Decoy,0.0,-7.07017,-5.84,-2.39,-4.327264364989305
COc1cc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc(OC)c1OC,C02502491_decoy,WEE1,Decoy,0.0,-8.02535,-9.58,-2.92,-8.312491258200286
COc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc(OC)c1OC,C02502492_decoy,WEE1,Decoy,0.0,-7.51568,-8.86,0.24,-11.340116101643403
CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N2CC(=O)Nc3ccccc32)C1=O,C04305439_decoy,WEE1,Decoy,0.0,-5.85939,-5.71,-2.92,-5.472649336789661
S[C@H]1NN[C@@H]([C@@H]2C=C(c3ccco3)N=N2)N1c1ccc2c(c1)OCO2,C38782846_decoy,WEE1,Decoy,0.0,-9.41879,-8.67,-3.44,-7.419677404879061
O=C(Nc1ccc(-c2nnnn2C2CC2)cc1)N[C@@H]1CCOc2ccccc21,C44016377_decoy,WEE1,Decoy,0.0,-8.12348,-11.56,-1.04,-14.49990122316817
Cc1cc(C(=O)Nc2n[nH]c(-c3ccc(C)s3)n2)c2c(C)nn(C)c2n1,C50006675_decoy,WEE1,Decoy,0.0,-7.9353,-8.9,-0.52,-7.142106423800064
Cc1n[nH]c(-c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2)n1,C50535150_decoy,WEE1,Decoy,0.0,-8.4844,-9.59,-0.78,-7.420431692054648
Nc1nc(Cn2cc(Br)c([N+](=O)[O-])n2)nc2sccc12,C50829997_decoy,WEE1,Decoy,0.0,-6.11464,-7.31,-0.87,-5.868555208668015
Cc1cc(C(=O)Nc2ccc(-c3nnco3)cc2)ccc1N1CCNC1=O,C55996171_decoy,WEE1,Decoy,0.0,-7.5028,-8.05,-3.3,-6.746572966544651
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)Nc2nncs2)C1,C56527888_decoy,WEE1,Decoy,0.0,-8.60171,-8.31,-2.91,-8.976651095910007
Cc1ccc(S(C)(=O)=O)c(NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)c1,C56768415_decoy,WEE1,Decoy,0.0,-8.0478,-9.6,-2.08,-9.212947367602393
Cn1ccc(NC(=O)CN2C(=O)NC3(CCC(C(C)(C)C)CC3)C2=O)n1,C26405847_decoy,WEE1,Decoy,0.0,-7.37769,-8.81,-3.12,-8.511951363875623
Cc1ccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c(O)c1,C17410574_decoy,WEE1,Decoy,0.0,-7.76604,-9.01,-3.94,-9.277120574116992
CNS(=O)(=O)c1cc(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)n(C)c1,C27102727_decoy,WEE1,Decoy,0.0,-9.20547,-8.51,-2.42,-7.849166754627687
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cc2)n1,C15991388_decoy,WEE1,Decoy,0.0,-8.06115,-9.63,-4.2,-7.357600767466387
O=C(Nc1nc(-c2ccc(F)cc2)n[nH]1)C1CCN(C(=O)N2CCCC2)CC1,C60614809_decoy,WEE1,Decoy,0.0,-6.30894,-9.85,-0.52,-7.18732198460518
COC(=O)c1ccc(C2=NN=C3OC(N)=C(C#N)[C@H](c4cccnc4)[C@H]32)cc1,C01112723_decoy,WEE1,Decoy,0.0,-8.22762,-8.82,-0.86,-8.083075294672676
COC(=O)c1ccc([C@@H]2C(C#N)=C(N)OC3=NN=C(c4ccncc4)[C@@H]32)cc1,C00759051_decoy,WEE1,Decoy,0.0,-8.01036,-4.82,-1.07,-4.589374767032633
N#CC1=C(N)OC2=NN=C(c3ccccn3)[C@H]2[C@@H]1c1ccc2c(c1)OCO2,C04171035_decoy,WEE1,Decoy,0.0,-8.08073,-8.6,-0.17,-7.293352325115122
O=C(CN1CCO[C@@H]2CCCC[C@H]21)NC(=O)Nc1ccc2c(c1)OCO2,C63567106_decoy,WEE1,Decoy,0.0,-9.0985,-8.81,-0.77,-8.215048125374553
CC1=NC(=O)[C@H](C[C@@H]2N[C@H](C3CC3)NN2c2ccc3c(c2)OCCO3)C(C)=N1,C65493116_decoy,WEE1,Decoy,0.0,-8.49505,-8.98,-1.12,-7.6076512290010845
O=C(Nc1ccc(N2CCNC2=O)cc1)c1cc(F)c(F)cc1[N+](=O)[O-],C65669324_decoy,WEE1,Decoy,0.0,-6.11115,-8.64,-0.98,-6.56926241175504
CNc1nc2c(s1)[C@@H](c1cc3c(c(OC)c1OC)OCO3)CC(=O)N2,C66091374_decoy,WEE1,Decoy,0.0,-8.39524,-7.4,-1.1,-8.104480854281302
Nc1c(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)cc(F)cc1[N+](=O)[O-],C66342182_decoy,WEE1,Decoy,0.0,-5.52795,-6.02,-0.79,-3.847678208939916
CC(C)n1cc(NC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cn1,C66412249_decoy,WEE1,Decoy,0.0,-7.93589,-8.78,-3.29,-9.509236213930803
Cc1c(C(=O)Nc2ccc3[nH]ncc3c2)nnn1-c1ccc2ncccc2c1,C66758505_decoy,WEE1,Decoy,0.0,-8.49875,-9.96,-0.3,-7.791168861560964
Cc1ccsc1C(=O)NNC(=O)c1nnn(-c2ccc3ncccc3c2)c1C,C66771809_decoy,WEE1,Decoy,0.0,-8.41425,-8.85,-2.06,-6.601074329482567
NS(=O)(=O)c1ccc(N2CCO[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1,C66815062_decoy,WEE1,Decoy,0.0,-7.2422,-5.96,-0.84,-4.562676170499754
N#Cc1ccc(C(=O)NNC(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)cc1,C67067101_decoy,WEE1,Decoy,0.0,-8.18642,-5.42,-1.13,-4.434497250908789
Cc1c(C(=O)NNC(=O)c2ccccc2)nnn1-c1cccc2cccnc12,C67133353_decoy,WEE1,Decoy,0.0,-6.37345,-9.56,-0.89,-7.33114529566468
Cc1ccc(NC(=O)c2nnn(-c3ccc4c(c3)OCCO4)c2C)c(O)c1,C67134287_decoy,WEE1,Decoy,0.0,-8.13724,-8.84,-0.67,-7.241113134405525
Cc1c(C(=O)NNc2ccc(F)cc2)nnn1-c1ccc2c(c1)OCCO2,C67246656_decoy,WEE1,Decoy,0.0,-8.24141,-9.29,-2.3,-7.504071977396984
C[C@@H]1CCCCN1C(=O)[C@@H](C)NC(=O)Nc1ccc(N2CCOC2=O)cc1,C67547936_decoy,WEE1,Decoy,0.0,-7.71067,-8.65,-2.08,-7.496785878451939
C[C@H](NC(=O)Nc1ccc(-c2ncon2)cc1)C(=O)N1CCCC[C@@H]1C,C67573237_decoy,WEE1,Decoy,0.0,-6.02306,-10.18,-1.29,-9.094325464897135
Cc1csc(NC(=O)C2CCN(C(=O)NCc3cc(C)on3)CC2)n1,C67610236_decoy,WEE1,Decoy,0.0,-8.69744,-8.91,-1.95,-8.877209406165523
N#CC1=C(N)N(c2cccnc2)C2=C(C(=O)CCC2)[C@@H]1c1ccc([N+](=O)[O-])s1,C04709686_decoy,WEE1,Decoy,0.0,-6.51838,-4.73,-1.19,-3.768543123054261
CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccc(N3CCCC3=O)cc1)C2=O,C07086430_decoy,WEE1,Decoy,0.0,-7.96364,-7.69,-0.46,-10.872529667910122
CNC(=O)[C@H]1CN(CC(=O)N2c3ccccc3NC(=O)C2(C)C)c2ccccc2O1,C07254202_decoy,WEE1,Decoy,0.0,-6.90403,-8.54,-1.35,-8.351885325877088
CNC(=O)[C@@H]1CN(CC(=O)N2c3ccccc3NC(=O)C2(C)C)c2ccccc2O1,C07254204_decoy,WEE1,Decoy,0.0,-7.23577,-9.69,-1.62,-8.005515547777774
CC(=O)N[C@H]1[C@@H](Oc2ccc(C)cc2C)O[C@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1O,C08301908_decoy,WEE1,Decoy,0.0,-6.35124,-5.96,-1.27,-5.014954071826741
CC(=O)N[C@@H]1[C@@H](Oc2ccc(C)cc2C)O[C@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1O,C08301912_decoy,WEE1,Decoy,0.0,-5.29755,-6.14,-1.56,-3.8439782340504016
CCOC(=O)C1=C(N)OC2=C(C(=O)C[C@@H](C)C2)[C@]12C(=O)N(C(C)=O)c1ccccc12,C10339246_decoy,WEE1,Decoy,0.0,-5.53846,-5.08,-1.55,-3.050409937143504
C[C@]1(c2ccccc2)NC(=O)N(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)C1=O,C12899684_decoy,WEE1,Decoy,0.0,-6.97805,-5.8,-1.51,-4.438622208214929
NC(=O)[C@H]1CN(S(=O)(=O)c2cccc3nsnc23)c2ccccc2O1,C19104012_decoy,WEE1,Decoy,0.0,-9.02509,-7.8,-1.56,-8.49775716781669
COc1ccc(C)cc1N1C[C@@H](C(=O)Nc2ccc3c(c2)OCC(=O)N3)CC1=O,C19664914_decoy,WEE1,Decoy,0.0,-8.11437,-9.57,-2.18,-10.057553022903496
NC(=O)N1CCC[C@@H](C(=O)N2CCC(Cn3cc(C4CCCC4)nn3)CC2)C1,C20232798_decoy,WEE1,Decoy,0.0,-8.59032,-8.42,-2.98,-6.820628811515265
COc1c2c(cc3c1[C@H](c1c([O-])[nH]c(=S)n(C4CC4)c1=O)[NH+](C)CC3)OCO2,C20410740_decoy,WEE1,Decoy,0.0,-7.46428,-4.8,-2.66,-4.291708683645834
COc1c2c(cc3c1[C@@H](c1c([O-])[nH]c(=S)n(C4CC4)c1=O)[NH+](C)CC3)OCO2,C18210644_decoy,WEE1,Decoy,0.0,-7.75484,-4.22,-1.57,-4.843031322100673
CC(=O)Nc1cccc(N2C[C@@H](C(=O)Nc3ccc4c(c3)OCO4)CC2=O)c1,C21657394_decoy,WEE1,Decoy,0.0,-8.25124,-8.03,-0.58,-8.684061170117527
Cc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)c(C)c1,C24556735_decoy,WEE1,Decoy,0.0,-8.0456,-10.03,-2.28,-9.27113733789672
Cc1nc(C)c2c(C)c(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)sc2n1,C25596978_decoy,WEE1,Decoy,0.0,-9.30901,-9.69,-1.01,-14.421066680952334
O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1cccs1)c1ccc2c(c1)OCO2,C26964465_decoy,WEE1,Decoy,0.0,-7.34109,-9.52,-4.44,-7.7879465565380865
O=C(NNC(=O)c1ccc2ccccc2n1)c1cccc(N2CCCS2(=O)=O)c1,C27685238_decoy,WEE1,Decoy,0.0,-8.44718,-10.65,-1.67,-8.913690706049543
CC(=O)Nc1cccc(NC(=O)[C@@H]2CN(S(C)(=O)=O)c3ccccc3O2)c1,C30943590_decoy,WEE1,Decoy,0.0,-8.76637,-8.93,-0.45,-8.174522914265504
Cc1ccc(-c2nc(C)c(C(=O)NN3C(=O)NC4(CCC(C)CC4)C3=O)s2)o1,C31211417_decoy,WEE1,Decoy,0.0,-8.13004,-7.94,-0.55,-10.443596589832405
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2=O,C36836440_decoy,WEE1,Decoy,0.0,-7.65112,-8.44,-0.39,-16.362869850699116
C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2=O,C36836442_decoy,WEE1,Decoy,0.0,-7.35511,-9.12,-0.25,-7.565408876336701
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccc(S(C)(=O)=O)cc1)C2=O,C36836444_decoy,WEE1,Decoy,0.0,-7.40659,-8.57,-0.28,-7.0829020293084985
CC(=O)N[C@H]1[C@H](Oc2ccccc2C)O[C@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1O,C04560781_decoy,WEE1,Decoy,0.0,-6.02636,-9.34,-3.2,-8.327502129720745
CC(=O)N[C@@H]1[C@@H](Oc2ccccc2C)O[C@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1O,C04560783_decoy,WEE1,Decoy,0.0,-6.49842,-6.03,-3.25,-4.110982778520782
CC(=O)N[C@H]1[C@H](Oc2cccc(C)c2)O[C@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1O,C04275595_decoy,WEE1,Decoy,0.0,-6.00984,-4.77,-1.52,-4.193322155644595
Cc1cc(NS(=O)(=O)c2c(C)n[nH]c2C)ccc1N1CCCS1(=O)=O,C36090382_decoy,WEE1,Decoy,0.0,-8.33607,-7.41,-1.99,-7.165835319753213
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)N[C@H]1CCS(=O)(=O)C1)C2=O,C41098405_decoy,WEE1,Decoy,0.0,-7.52027,-5.03,-1.09,-4.291270386453198
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1nn(-c2ccccc2)c2c1CCC2,C45683796_decoy,WEE1,Decoy,0.0,-8.28162,-10.13,-1.69,-8.149344770098475
O=C(Nc1ccccc1N1CCCC1=O)N[C@@H]1CCCN(c2ncccn2)C1,C47102966_decoy,WEE1,Decoy,0.0,-7.76261,-8.13,-2.62,-6.639896272422218
NC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc4c(c3)OCO4)C(=O)[C@@H]2[C@H]2c3ccccc3C=CN12,C16040838_decoy,WEE1,Decoy,0.0,-6.00822,-5.83,-1.44,-3.822212919585065
O=C(NNC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O)c1ccc2c(c1)OCO2,C53086027_decoy,WEE1,Decoy,0.0,-7.56699,-6.09,-0.4,-5.0104032342727685
O=C(NC1CCN(C(=O)Nc2ccc(-n3cncn3)cc2)CC1)c1ccsc1,C56607791_decoy,WEE1,Decoy,0.0,-7.48855,-7.35,-3.19,-5.821716825171526
Cc1nn(C)cc1NC(=O)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccco1)N2,C00919797_decoy,WEE1,Decoy,0.0,-7.58647,-9.47,-2.61,-11.478970636847146
CC(=O)N1CCc2cc(NC(=O)CNC(=O)c3ccc4c(c3)OCO4)ccc21,C22642851_decoy,WEE1,Decoy,0.0,-7.48175,-9.38,-1.98,-7.902872285605205
O=C(Nc1cccc(N2CCNC2=O)c1)[C@H]1CCCN(C(=O)N2CCCC2)C1,C47042155_decoy,WEE1,Decoy,0.0,-7.811,-8.82,-0.92,-7.559340046817378
C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)N[C@]1(C)CCS(=O)(=O)C1)C2=O,C41094933_decoy,WEE1,Decoy,0.0,-7.72989,-5.71,-1.0,-4.224616586331903
CC(=O)N1CCC(NC(=O)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)CC1,C49207379_decoy,WEE1,Decoy,0.0,-9.02125,-9.84,-1.05,-14.076299854511593
CC1=NN=C2OC(N)=C(C#N)C3(CCN(C(=O)OCc4ccccc4)CC3)[C@H]12,C06507101_decoy,WEE1,Decoy,0.0,-8.28637,-9.42,-3.75,-8.511574510097107
C[C@@H]1[C@@H](NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)C(=O)N(c2ccccc2)N1C,C63541407_decoy,WEE1,Decoy,0.0,-8.19603,-8.79,-3.08,-7.225855394565855
Cc1nn(C)c2ncc(NC(=O)N[C@@H](C)c3ccc(N4CCCC4=O)cc3)cc12,C65993688_decoy,WEE1,Decoy,0.0,-7.95895,-9.36,-3.43,-6.761841139684837
CC(C)n1cc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc4[nH]ncc4c3)C2)cn1,C66673204_decoy,WEE1,Decoy,0.0,-8.2236,-10.05,-1.94,-7.451789656587979
CNC(=O)c1ccccc1NC(=O)c1nnn(-c2ccc3ncccc3c2)c1C,C66756948_decoy,WEE1,Decoy,0.0,-7.91521,-10.07,-2.66,-7.588767147789678
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)o1,C66770989_decoy,WEE1,Decoy,0.0,-8.62431,-5.67,-1.94,-5.185463577013583
CNC(=O)C1CCC(NC(=O)c2nnn(-c3ccc4ncccc4c3)c2C)CC1,C66831999_decoy,WEE1,Decoy,0.0,-7.77709,-9.21,-1.85,-7.201069456263012
Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)N[C@@H](C)c1nncn1C,C66967348_decoy,WEE1,Decoy,0.0,-6.83446,-9.07,-2.54,-6.832017149728905
CC(=O)Nc1cccc(NC(=O)c2nnn(-c3cccc4cccnc34)c2C)c1,C67133148_decoy,WEE1,Decoy,0.0,-8.19098,-9.22,-1.4,-7.656007122158539
Cc1c(C(=O)NNC(=O)c2ccccc2F)nnn1-c1cccc2cccnc12,C67133247_decoy,WEE1,Decoy,0.0,-8.08632,-9.83,-2.09,-8.208925005161657
Cc1nn(-c2ncnc3[nH]cnc23)c2c1[C@@H](c1ccc(F)cc1F)CC(O)=N2,C20744557_decoy,WEE1,Decoy,0.0,-9.04274,-9.11,-0.68,-10.20440364690335
C[C@H](NC(=O)Nc1cccc(N2CCOC2=O)c1)C(=O)N1CCSCC1,C67541988_decoy,WEE1,Decoy,0.0,-7.5905,-8.22,-1.49,-7.2500722638128
OC[C@@H]1O[C@H](Oc2ccc(Br)cc2)[C@H](O)[C@H](O)[C@@H]1O,C04984416_decoy,WEE1,Decoy,0.0,-6.69268,-8.28,-1.39,-9.418698410279582
NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1,C00293762_decoy,WEE1,Decoy,0.0,-7.1978,-5.0,-0.82,-4.827163545517632
Nc1nc(N)nc(CSCc2cccc3cccnc23)n1,C12621446_decoy,WEE1,Decoy,0.0,-7.49182,-4.68,-1.36,-4.7646363199503625
CC(=O)NCCC(=O)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2,C14230452_decoy,WEE1,Decoy,0.0,-8.60311,-8.03,0.45,-17.59914267113528
CC[C@@H]1CN(CC(N)=O)c2cc(-c3csc(N)n3)ccc2O1,C19757554_decoy,WEE1,Decoy,0.0,-8.8597,-7.04,-1.25,-9.812023872913011
C[C@H](NC(=O)c1ccc(CNC(N)=O)cc1)[C@H]1CCCO1,C27869791_decoy,WEE1,Decoy,0.0,-7.22159,-8.53,-0.68,-7.054554649865466
CNS(=O)(=O)c1ccc(N[C@@H](C)c2ccncc2)c(N)c1,C35693139_decoy,WEE1,Decoy,0.0,-7.90192,-8.28,-1.47,-7.591615404371953
C[C@@H](NS(=O)(=O)c1ccc2nc(NN)ccc2c1)C1CC1,C35734075_decoy,WEE1,Decoy,0.0,-8.54559,-9.16,-2.4,-9.944441197336406
CC(C)(C)Oc1nc(N2CCC[C@@H](C(N)=O)C2)ccc1N,C37066399_decoy,WEE1,Decoy,0.0,-6.99487,-6.48,-0.06,-6.5070603686239625
Nc1ccc(SCC(=O)NC(=O)NCc2ccco2)cc1,C37181655_decoy,WEE1,Decoy,0.0,-7.52152,-7.27,-1.29,-7.296625833373423
Nc1n[nH]cc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1,C37558255_decoy,WEE1,Decoy,0.0,-5.25595,-7.02,-1.04,-5.591750386267203
Cc1ccc(C#CCO)cc1S(=O)(=O)N[C@@H](C)C(N)=O,C37579719_decoy,WEE1,Decoy,0.0,-7.60918,-8.89,-1.85,-7.848722398626447
Cc1ccc(C#CCO)cc1S(=O)(=O)N[C@H](C)C(N)=O,C37579721_decoy,WEE1,Decoy,0.0,-8.53559,-9.2,-2.13,-7.698978802932364
CC[C@H](C)[C@@H](O)[C@](C)(O)/C=C/C1=CC2=CC(=O)[C@@](C)(O)[C@H](O)[C@@H]2CO1,C35455854_decoy,WEE1,Decoy,0.0,-9.88094,-5.52,-3.2,-5.747128632621132
C[C@H]1[C@@H](NS(=O)(=O)c2ccnc(NN)c2)CCC[C@@H]1C,C38008926_decoy,WEE1,Decoy,0.0,-7.91057,-7.77,-1.79,-8.247101848762407
NS(=O)(=O)Nc1cccc(NC(=O)Cc2cccs2)c1,C40217518_decoy,WEE1,Decoy,0.0,-9.78874,-6.78,0.29,-8.640585425351496
NC(=O)CN(C1CCCC1)S(=O)(=O)c1ccc(F)c(N)c1,C40329584_decoy,WEE1,Decoy,0.0,-7.65379,-7.86,-1.95,-12.00111987677581
CCCn1cc(N)cc1C(=O)N1C[C@H](C(N)=O)CC[C@@H]1C,C40330491_decoy,WEE1,Decoy,0.0,-8.58066,-7.23,-1.46,-8.278454733943894
Cc1ncsc1C(=O)NC1(/C(N)=N/O)CCC(C)CC1,C40372503_decoy,WEE1,Decoy,0.0,-7.91261,-7.52,-0.95,-9.745592642100174
CCC1CCC(NC(=O)c2ccoc2C)(/C(N)=N/O)CC1,C40372723_decoy,WEE1,Decoy,0.0,-7.24098,-4.56,-0.57,-4.864954983080336
Cc1cc(F)ccc1S(=O)(=O)NC(C)(C)/C(N)=N/O,C40377042_decoy,WEE1,Decoy,0.0,-6.58521,-7.0,-1.2,-7.466965313762285
CS(=O)(=O)NCCNc1ncc(Br)cc1N,C40713756_decoy,WEE1,Decoy,0.0,-7.32166,-6.32,-1.83,-6.831420812485487
Cc1ccsc1CNC(=O)C(=O)Nc1ccc(C(N)=O)cc1,C41949126_decoy,WEE1,Decoy,0.0,-7.97698,-8.32,-2.65,-8.052927211490296
Cc1ccc(N)cc1S(=O)(=O)N1CCCC[C@@H]1C(N)=O,C42272399_decoy,WEE1,Decoy,0.0,-7.41442,-9.23,-2.61,-2.206135449252325
NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc(N)c(F)cc1F,C42272457_decoy,WEE1,Decoy,0.0,-7.2592,-8.68,-1.44,-7.510376958228373
Nc1cc(N(Cc2ccco2)C2CC2)cc(S(N)(=O)=O)c1,C42692971_decoy,WEE1,Decoy,0.0,-8.5762,-7.81,-1.35,-7.713294358045705
Cc1ccc(SCC(=O)NNC(=O)NC2CCC(O)CC2)cc1,C42962418_decoy,WEE1,Decoy,0.0,-8.08522,-7.86,-1.17,-7.470695709889502
[NH3+]C1CCN(C(=O)NCC2(CC(=O)[O-])CCCCC2)CC1,C43414323_decoy,WEE1,Decoy,0.0,-7.46498,-4.39,-1.9,-4.478908708633495
[NH3+][C@H]1CCCC[C@@H]1NC(=O)N1CCC[C@H](CCC(=O)[O-])C1,C43587435_decoy,WEE1,Decoy,0.0,-6.49967,-7.13,-3.63,-6.195036280555194
Cc1cc([C@H](C)NS(=O)(=O)c2ccc(NN)cc2)c(C)o1,C44731543_decoy,WEE1,Decoy,0.0,-7.29289,-8.27,-1.75,-7.958981775539785
C[C@]1(Nc2cc3c(cc2N)NC(=O)CC3)CCS(=O)(=O)C1,C44924262_decoy,WEE1,Decoy,0.0,-7.1393,-7.68,-0.89,-6.677405361396205
CN(CC(F)(F)F)C(=O)CSc1nc(N)cc(N)n1,C48599713_decoy,WEE1,Decoy,0.0,-6.73603,-6.78,-1.87,-6.326922138294186
CC[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccnc(NN)c1,C49122876_decoy,WEE1,Decoy,0.0,-7.83059,-7.08,-2.98,-8.657568400175654
CC[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccnc(NN)c1,C49122879_decoy,WEE1,Decoy,0.0,-7.98475,-7.27,-3.96,-9.26926879051804
Cc1cc([C@@H](C)NS(=O)(=O)c2ccc(NN)nc2)c(C)s1,C49512352_decoy,WEE1,Decoy,0.0,-8.3896,-7.63,-1.45,-8.298312761577716
Cc1ccc([C@H](C)NS(=O)(=O)c2ccnc(NN)c2)cc1,C49560642_decoy,WEE1,Decoy,0.0,-6.64116,-8.38,-1.51,-8.94908743303963
Cc1cc(Sc2cc(N)cc(S(N)(=O)=O)c2)n(C)n1,C52308422_decoy,WEE1,Decoy,0.0,-8.68684,-6.99,-0.47,-7.8810779362954175
C[C@](NC(=O)N1CCC[C@@H]([NH3+])C1)(C(=O)[O-])c1ccccc1,C52880491_decoy,WEE1,Decoy,0.0,-6.51232,-4.39,-1.67,-4.1736984991608725
C[C@@H]1CCC[C@@](CO)(NC(=O)[C@@H]2CCCN(C(N)=O)C2)C1,C53106302_decoy,WEE1,Decoy,0.0,-7.46408,-4.54,-3.37,-5.38611186993095
C[C@@H](NC(=O)c1n[nH]c(N)n1)c1ccc(C(F)(F)F)cc1,C55166298_decoy,WEE1,Decoy,0.0,-5.88981,-8.64,-1.36,-6.956678021419417
CC(C)c1nc(CSCc2nc(N)nc(N)n2)cs1,C56229194_decoy,WEE1,Decoy,0.0,-8.51814,-5.75,-1.23,-6.4613611377827525
NC(N)=NS(=O)(=O)c1ccc(/N=C/c2cccs2)cc1,C06057116_decoy,WEE1,Decoy,0.0,-6.95731,-8.58,0.08,-6.83918277617401
COC(=O)C1=C(N)OC(C)=C(C(N)=O)[C@H]1c1sccc1C,C58949216_decoy,WEE1,Decoy,0.0,-7.40206,-5.19,-0.51,-4.340067581990255
CCOC(=O)C1=C(N)OC(C)=C(C(N)=O)[C@H]1c1ccc(C)s1,C58949384_decoy,WEE1,Decoy,0.0,-5.74543,-4.02,-0.32,-4.652978214505702
N/C(=N/O)[C@@H]1CCC[C@@H]1NS(=O)(=O)Cc1ccccc1,C61888210_decoy,WEE1,Decoy,0.0,-6.89624,-7.52,-3.37,-6.577457440955268
C[C@H](Cc1ccc(F)cc1)NS(=O)(=O)c1c[nH]nc1N,C62051910_decoy,WEE1,Decoy,0.0,-6.37764,-6.85,-2.11,-6.861886011605256
Cc1ccc(C(N)=O)cc1NC(=O)C(=O)N[C@@H](C)C(C)C,C63815318_decoy,WEE1,Decoy,0.0,-7.75144,-7.39,-3.15,-9.17915228052538
C[C@H](NC(=O)N[C@H](C)C1CC1)c1ccc(S(N)(=O)=O)cc1,C65451796_decoy,WEE1,Decoy,0.0,-7.53975,-4.95,-1.29,-5.447581944000481
O=C(CC1CCCCC1)NNC(=O)NC1CCC(O)CC1,C67103677_decoy,WEE1,Decoy,0.0,-8.18742,-7.76,-1.0,-7.022158504792731
Cc1cc([C@@H](C)NC(=O)c2ccc(CNC(N)=O)cc2)c(C)o1,C67330344_decoy,WEE1,Decoy,0.0,-7.73323,-8.01,-1.14,-7.831684300969847
N#Cc1c(N)c(C(=O)[O-])nn(-c2cccc(C(F)(F)F)c2)c1=O,C01617452_decoy,WEE1,Decoy,0.0,-6.47258,-8.46,-0.59,-7.580077612703523
O=C(NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-])c1ccc(F)cc1,C13255369_decoy,WEE1,Decoy,0.0,-6.90217,-8.88,-0.83,-12.40200163459133
CC(=O)Nc1ccc(NC(=O)CC2(C(=O)[O-])CCCCC2)cc1,C13255828_decoy,WEE1,Decoy,0.0,-7.63463,-9.79,-1.29,-12.087436808051402
C[C@]1(c2ccccc2)C[C@@H]1C(=O)NNC(=O)c1ccccc1C(=O)[O-],C00333535_decoy,WEE1,Decoy,0.0,-6.23818,-5.6,-1.51,-4.289324310427807
NS(=O)(=O)c1cccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2)c1,C22411091_decoy,WEE1,Decoy,0.0,-7.66829,-8.87,-0.73,-7.797664902375567
C[C@@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc(C(=O)[O-])s1,C35425609_decoy,WEE1,Decoy,0.0,-7.33542,-6.93,-2.48,-6.861349593976469
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)N[C@H](C)CO,C35651037_decoy,WEE1,Decoy,0.0,-7.51626,-7.71,-1.7,-8.527309511826887
Cc1c(N)cccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-],C36296272_decoy,WEE1,Decoy,0.0,-5.69548,-4.9,-1.32,-4.266169498279918
Cc1ccc(S(=O)(=O)[N-]c2cc(S(N)(=O)=O)ccc2F)cc1,C36395877_decoy,WEE1,Decoy,0.0,-8.18651,-5.79,-1.34,-4.6362953857063305
Cc1cc(S(=O)(=O)Nc2c(C)n[nH]c2C)sc1C(=O)[O-],C36736446_decoy,WEE1,Decoy,0.0,-8.06124,-8.15,-1.9,-7.489473917822069
Cc1cc([N-]S(=O)(=O)c2cc(N)cc(Cl)c2F)on1,C37063573_decoy,WEE1,Decoy,0.0,-6.27862,-7.59,-2.96,-6.474698225195761
C[C@@H](Oc1cc(C(=O)[O-])ccc1N)C(=O)N1CCCCC1,C37289433_decoy,WEE1,Decoy,0.0,-7.01201,-8.42,-4.69,-4.5130029757204015
CC1CCC(Oc2ccc(S(N)(=O)=O)cc2C(=O)[O-])CC1,C37309192_decoy,WEE1,Decoy,0.0,-8.40567,-7.66,-0.27,-8.389547735043736
CC(=O)N[C@@H](C(=O)Nc1cc(C)c(C(=O)[O-])s1)C(C)C,C37404712_decoy,WEE1,Decoy,0.0,-7.11453,-7.33,-0.81,-7.731858889688715
C[C@H](NS(=O)(=O)c1c[nH]c(C(=O)[O-])c1)c1ccc(Cl)cc1,C37464350_decoy,WEE1,Decoy,0.0,-7.11511,-7.72,-1.58,-7.845519608645057
O=C([O-])c1cn[nH]c1S(=O)(=O)N[C@@H]1CCc2ccccc21,C37732120_decoy,WEE1,Decoy,0.0,-6.67615,-4.49,-1.62,-4.673381397234071
NC(=O)CC1CCN(C(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])CC1,C37835134_decoy,WEE1,Decoy,0.0,-6.53532,-4.24,-5.38,-3.390970407307401
O=C(NNC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-])c1ccc(Cl)cc1,C04651761_decoy,WEE1,Decoy,0.0,-7.75495,-4.96,-0.96,-5.184534690163909
CC(=O)Nc1ccc(NC(=O)[C@@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C(=O)[O-])cc1,C04155831_decoy,WEE1,Decoy,0.0,-7.20597,-9.5,-1.35,-12.205997677909991
CC(=O)Nc1ccc(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(=O)[O-])cc1,C39346845_decoy,WEE1,Decoy,0.0,-7.36882,-5.01,-1.01,-4.803161281036447
CC1(C)CC[C@@H](C(=O)NNC(=O)c2ccccc2)[C@]1(C)C(=O)[O-],C12384474_decoy,WEE1,Decoy,0.0,-5.53042,-7.49,-2.62,-6.944428077403529
CC1(C)[C@@H](C(=O)NNC(=O)[C@@H]2C[C@@H]2c2ccccc2)CC[C@]1(C)C(=O)[O-],C39462732_decoy,WEE1,Decoy,0.0,-7.10921,-8.01,-3.51,-6.940276380924567
O=C([O-])/C=C/c1ccc(NC(=O)Nc2nncs2)cc1,C40520845_decoy,WEE1,Decoy,0.0,-6.51335,-8.94,-1.32,-7.053896497752355
Cc1ccc(C(=O)[O-])cc1NC(=O)N[C@@H]1CCS(=O)(=O)C1,C40532897_decoy,WEE1,Decoy,0.0,-6.97229,-6.74,-2.14,-6.53391230329896
C[C@H]1CCCN1C(=O)NC1(c2nc(C(=O)[O-])c[nH]2)CCC1,C40604129_decoy,WEE1,Decoy,0.0,-6.51532,-5.38,-2.24,-5.594504050410187
C[C@](Sc1nncn1N)(C(=O)[O-])c1c(F)cccc1F,C41991885_decoy,WEE1,Decoy,0.0,-6.57673,-5.25,-0.33,-4.110431029826081
Cc1cc(CNC(=O)Nc2ccc(F)cc2C(=O)[O-])on1,C45012726_decoy,WEE1,Decoy,0.0,-5.46348,-6.7,-0.59,-5.999069963771411
O=C(Nc1ccc(C(=O)[O-])c(Cl)c1)N[C@H]1CCS(=O)(=O)C1,C48813954_decoy,WEE1,Decoy,0.0,-7.24213,-8.61,-0.8,-10.607023625876936
Cc1occc1/C([O-])=C(/C#N)C(=O)c1ccc(C(N)=O)cc1,C49165175_decoy,WEE1,Decoy,0.0,-7.39606,-8.59,0.21,-7.563758766831546
Cn1cc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cc2N)cn1,C50252566_decoy,WEE1,Decoy,0.0,-5.22277,-7.92,-1.22,-5.498264749509283
CC(C)c1ncc(N2CCCC[C@H]2C(N)=O)c(C(=O)[O-])n1,C50364231_decoy,WEE1,Decoy,0.0,-6.59886,-4.05,-1.25,-3.784249597710933
Cc1ccc(C(N)=S)cc1[N-]S(=O)(=O)c1cnn(C)c1,C50429813_decoy,WEE1,Decoy,0.0,-7.98646,-7.48,-1.94,-8.392118004898263
CC(C)c1ccc([N-]S(=O)(=O)c2cnc(N)nc2)cc1,C50633927_decoy,WEE1,Decoy,0.0,-6.95064,-5.9,-1.06,-6.856651958805383
Cc1ccc([N-]S(=O)(=O)c2c(N)nc3sccn23)cc1,C50649459_decoy,WEE1,Decoy,0.0,-6.95231,-6.22,-1.54,-7.192052801967547
Nc1ncc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)cn1,C50654124_decoy,WEE1,Decoy,0.0,-6.93628,-6.12,-0.77,-6.1586555768712055
CC(C)c1csc([N-]S(=O)(=O)c2cccnc2N)n1,C50672141_decoy,WEE1,Decoy,0.0,-8.49419,-6.34,-0.08,-7.749762398116868
O=C([O-])CC[C@H]1CCCN(C(=O)N[C@@H]2CCCC[C@H]2O)C1,C52012312_decoy,WEE1,Decoy,0.0,-6.33304,-4.48,-4.63,-2.670915415917724
C[C@H](NC(=O)c1ccc(Br)s1)/C([O-])=N/c1ncn[nH]1,C48572242_decoy,WEE1,Decoy,0.0,-7.71208,-7.19,-0.63,-7.553215144148427
Cc1nnc([O-])c(C(=O)NC2(CO)CCC(C)CC2)c1C,C53103429_decoy,WEE1,Decoy,0.0,-7.62717,-7.85,-1.71,-7.585505892582521
Cc1ccc2nc(NC(=O)N[C@H](C(=O)[O-])C3CC3)sc2c1,C54524272_decoy,WEE1,Decoy,0.0,-8.26402,-8.08,-0.47,-7.721072136650389
Cc1nc(N)sc1C(=O)N1CCc2sccc2[C@H]1C(=O)[O-],C55175898_decoy,WEE1,Decoy,0.0,-7.32016,-7.67,-2.15,-6.36222408384885
Cn1cc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)c(N)n1,C61099044_decoy,WEE1,Decoy,0.0,-5.97317,-8.49,-1.4,-6.817448643658159
C[C@@H]1CCC[C@H](NC(=O)NC(=O)CC(C)(C)CC(=O)[O-])C1,C61827665_decoy,WEE1,Decoy,0.0,-6.4852,-5.46,-3.44,-4.137923504259984
NC(=O)c1c(-n2cc(C(=O)[O-])nn2)sc2c1CCCC2,C62427326_decoy,WEE1,Decoy,0.0,-7.94607,-9.18,0.44,-15.258398643666682
O=C([O-])c1cccc(Br)c1NC(=O)N(CCO)C1CC1,C62827303_decoy,WEE1,Decoy,0.0,-7.10533,-3.79,-2.29,-4.0578833419800615
Cc1sc(NC(=O)NC2CCOCC2)c(C(=O)[O-])c1C,C62828015_decoy,WEE1,Decoy,0.0,-7.60943,-7.43,-0.96,-7.114433936898425
Cc1ccc([C@H](C)NC(=O)Nc2sccc2C(=O)[O-])o1,C62828311_decoy,WEE1,Decoy,0.0,-7.40417,-7.1,-1.5,-8.03131081933893
Cc1sc(NC(=O)NC[C@@H]2CCCCO2)c(C(=O)[O-])c1C,C62828704_decoy,WEE1,Decoy,0.0,-7.03271,-7.32,-1.2,-9.999030626037085
CCC[C@@]1(C(=O)[O-])CCN(C(=O)c2sc(N)nc2C)C1,C62918982_decoy,WEE1,Decoy,0.0,-7.06219,-7.14,-0.88,-7.738928007358477
Cc1nnc(NNC(=O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)nc1[O-],C67106430_decoy,WEE1,Decoy,0.0,-6.55012,-8.64,-1.74,-6.886347350482429
Cc1cc(NS(=O)(=O)c2cc(N)c(F)cc2F)n(C)n1,C21812628_decoy,WEE1,Decoy,0.0,-6.72108,-7.57,-1.14,-7.252960023595918
C#Cc1cccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1,C24434376_decoy,WEE1,Decoy,0.0,-5.82883,-4.56,-2.15,-3.688679877194248
Nc1nc2scc(-c3ccc4c(c3)CCC(=O)N4)n2n1,C31891318_decoy,WEE1,Decoy,0.0,-8.41319,-8.05,-0.91,-6.322117097220223
COc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1,C32534144_decoy,WEE1,Decoy,0.0,-7.05963,-8.25,-0.42,-6.675511626105415
CNS(=O)(=O)c1ccc(N2CCOC(C)(C)C2)c(N)c1,C36231999_decoy,WEE1,Decoy,0.0,-7.63208,-8.23,-1.58,-7.558191526633887
Cc1ccc(N)c(C)c1S(=O)(=O)Nc1ccn(C)n1,C37560100_decoy,WEE1,Decoy,0.0,-6.12307,-7.72,-1.21,-6.403423134652056
NC(=O)c1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1,C00288072_decoy,WEE1,Decoy,0.0,-6.98343,-9.16,-0.36,-7.58188675937989
NNc1cc(S(=O)(=O)N2CC[C@@H]3CCCC[C@@H]3C2)ccn1,C38009132_decoy,WEE1,Decoy,0.0,-8.10251,-8.1,-1.26,-13.949254253743026
[H]/N=C1/SC(N)=C(C#N)[C@H](c2ccc(OC)cc2OC)[C@@H]1C#N,C00285972_decoy,WEE1,Decoy,0.0,-5.53175,-4.13,-1.38,-3.488795299506094
CC1=C(S(=O)(=O)Nc2ccc(N)cc2C)[C@H](C)N=N1,C38719662_decoy,WEE1,Decoy,0.0,-5.98692,-6.59,-0.85,-6.590310020369302
NC1=N[C@@H](Nc2ccc(Br)cc2)C2=NC=NC2=N1,C39275509_decoy,WEE1,Decoy,0.0,-7.30823,-6.78,-0.39,-6.604306494102047
Cc1nnc(O[C@@H]2CCC[C@@H](C)C2)c(/C(N)=N/O)c1C,C40291963_decoy,WEE1,Decoy,0.0,-8.0033,-7.84,-0.76,-7.794392349671462
Cc1ccc(S(N)(=O)=O)cc1NC(=O)c1scnc1C,C40378555_decoy,WEE1,Decoy,0.0,-8.68198,-3.7,-1.1,-4.206425222975422
Nc1csc(S(=O)(=O)N2CCC[C@H](c3ccn[nH]3)C2)c1,C41068354_decoy,WEE1,Decoy,0.0,-8.42772,-8.13,-1.4,-7.619322983805271
Nc1nnc(S(=O)(=O)NC2CCCCCC2)s1,C41415040_decoy,WEE1,Decoy,0.0,-8.43283,-6.3,-1.29,-6.211115143035212
C[C@H]1CN(C(=O)C2(/C(N)=N/O)CCCC2)CC(C)(C)O1,C41684295_decoy,WEE1,Decoy,0.0,-6.50816,-5.41,-0.29,-3.7848692212782864
O=C(NNC(=O)c1ccc(F)cc1)Nc1nccs1,C42755484_decoy,WEE1,Decoy,0.0,-7.26082,-7.91,-2.57,-7.392919631955104
Nc1cc(S(=O)(=O)N2CCO[C@H]3CCC[C@@H]32)ccc1O,C43424145_decoy,WEE1,Decoy,0.0,-8.28229,-7.85,-1.19,-7.578412860056869
Cc1cc(S(=O)(=O)Nc2ccnn2C)cc(N)c1C,C44593512_decoy,WEE1,Decoy,0.0,-6.93422,-8.62,-0.84,-8.381697890885283
C[C@@H]1CN(C(=O)C2(/C(N)=N/O)CCCCC2)[C@H](C)CO1,C44785203_decoy,WEE1,Decoy,0.0,-6.20832,-4.65,-1.01,-4.6753050318463885
C[C@H]1CN(C(=O)C2(/C(N)=N/O)CCCCCC2)[C@@H](C)CO1,C44785210_decoy,WEE1,Decoy,0.0,-7.49587,-4.76,-3.63,-4.639165138597713
CN(C(=O)C1(/C(N)=N/O)CCCCCC1)C1CCOCC1,C44785405_decoy,WEE1,Decoy,0.0,-6.13646,-4.64,-1.87,-3.134170251651298
CC1(C)COCCN1C(=O)C1(/C(N)=N/O)CCCCC1,C44785803_decoy,WEE1,Decoy,0.0,-3.80656,-4.76,-2.59,-2.7209420573868406
CC1(C)COCCN1C(=O)C1(/C(N)=N/O)CCCCCC1,C44785804_decoy,WEE1,Decoy,0.0,-5.91409,-5.12,-2.75,-4.732357433312835
C[C@@H]1CCCC[C@H]1N(C)C(=O)C1(/C(N)=N/O)CCOCC1,C44792171_decoy,WEE1,Decoy,0.0,-5.08436,-4.73,-0.98,-2.884504197615287
N/C(=N/O)C1(C(=O)N2CCO[C@H]3CCCC[C@@H]32)CCCC1,C44792805_decoy,WEE1,Decoy,0.0,-7.49047,-8.63,-0.99,-9.13462151986842
COCc1[nH]nc2c1[C@@H]([C@@H]1CC=CCC1)C(C#N)=C(N)O2,C47309404_decoy,WEE1,Decoy,0.0,-7.63041,-8.29,-0.45,-8.605380710472737
CN(C(=O)N1CCC([NH3+])CC1)c1ccccc1C(=O)[O-],C48836200_decoy,WEE1,Decoy,0.0,-4.26826,-4.41,-3.11,-3.2071456132586147
Cc1n[nH]cc1NC(=O)c1[nH]nc(C2CC2)c1Br,C49475875_decoy,WEE1,Decoy,0.0,-7.75298,-7.43,0.21,-7.410938548646027
Cc1sc2nc(CSc3ncn[nH]3)nc(N)c2c1C,C49933565_decoy,WEE1,Decoy,0.0,-8.21212,-8.45,0.55,-7.478110174147209
Cc1cc(C)cc(N(C)S(=O)(=O)c2c[nH]nc2N)c1,C49978549_decoy,WEE1,Decoy,0.0,-7.04769,-8.81,-1.54,-8.023746518913878
CC[C@H]1CO[C@@H](C)CN1C(=O)c1n[nH]c(C(C)C)c1N,C50309955_decoy,WEE1,Decoy,0.0,-6.48831,-4.7,-1.75,-3.74464611550352
CCCc1[nH]nc(C(=O)N2CCO[C@H]3CCC[C@H]32)c1N,C50323145_decoy,WEE1,Decoy,0.0,-7.29454,-8.04,-2.39,-8.19782039325322
CSc1nc2n(n1)C(N)=C(C#N)[C@@H](c1ccccc1)N2,C06757815_decoy,WEE1,Decoy,0.0,-7.92707,-7.81,-2.38,-7.195635021696908
Cc1cc(S(N)(=O)=O)cc(NC(=O)[C@H]2CCCCO2)c1C,C50973445_decoy,WEE1,Decoy,0.0,-7.63035,-4.67,-1.63,-4.254545419438666
Nc1c(Sc2ncnc3nc[nH]c23)ccc2ncccc12,C51021860_decoy,WEE1,Decoy,0.0,-7.32167,-8.9,-0.04,-10.779829107528789
Nc1ccc2nc(Sc3ncnc4nc[nH]c34)ccc2c1,C51021888_decoy,WEE1,Decoy,0.0,-8.11597,-7.01,-0.61,-7.746666384451768
Nc1ncc(S(=O)(=O)N[C@H]2CCCc3ccccc32)cn1,C51634170_decoy,WEE1,Decoy,0.0,-7.85039,-7.99,-1.78,-10.698756506928577
Cc1nc(N)sc1C(=O)Nc1ccc2c(c1)OCO2,C55171067_decoy,WEE1,Decoy,0.0,-8.6372,-6.7,-0.43,-6.661527299663859
Cc1cc(/C=N/O)c(C)n1-c1ccc(S(N)(=O)=O)cc1,C13479807_decoy,WEE1,Decoy,0.0,-8.58755,-9.41,-0.77,-7.952961769449884
Cc1c(C#N)c(S[C@@H](C)C(=O)NC(N)=O)nc2c1CCC2,C22122249_decoy,WEE1,Decoy,0.0,-7.96309,-8.74,-0.74,-9.553956306926407
CCn1c(Sc2ccc3scnc3c2N)n[nH]c1=O,C61593949_decoy,WEE1,Decoy,0.0,-8.00419,-7.61,-0.56,-10.670830351395455
N/C(=N/O)c1nccnc1N1CCC2(CCCCC2)CC1,C61820166_decoy,WEE1,Decoy,0.0,-6.58015,-6.05,-0.95,-6.359527426274102
COc1ccc(F)c([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)c1,C06812811_decoy,WEE1,Decoy,0.0,-7.49608,-8.1,-1.7,-9.50150088810684
Nc1cc2c(cc1NC(=O)c1cscn1)OCCCO2,C62353489_decoy,WEE1,Decoy,0.0,-8.09418,-7.25,-0.39,-6.659901072973812
NNc1ccc(S(=O)(=O)N2CCC3(CCCC3)CC2)cn1,C62960037_decoy,WEE1,Decoy,0.0,-7.64504,-8.51,-0.33,-8.648498500379668
Nc1[nH+]cc(-c2cccc(C(=O)N3CCCC3)c2)cc1C(=O)[O-],C65349076_decoy,WEE1,Decoy,0.0,-7.18482,-5.02,-0.59,-4.389998808013625
CS(=O)(=O)c1ccc(-c2ccc(N)[nH+]c2C(=O)[O-])cc1,C65356057_decoy,WEE1,Decoy,0.0,-10.5266,-5.23,-0.45,-4.818520179255374
Cc1[nH]nc2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2,C04565435_decoy,WEE1,Decoy,0.0,-7.0628,-4.71,-0.71,-3.424324966974148
Cc1ccsc1C(=O)NNC(=O)c1ccc2[nH]cnc2c1,C67181471_decoy,WEE1,Decoy,0.0,-7.55024,-8.88,-1.85,-7.290450869337111
CC(C)[C@@H]1C[C@@](O)(C2(O)CCCCC2)ON1,C00092501_decoy,WEE1,Decoy,0.0,-7.39526,-4.32,-2.48,-3.606411064439493
C[C@H]1CCc2nc(NN)nc(C(F)(F)F)c2C1,C04184987_decoy,WEE1,Decoy,0.0,-6.22079,-4.37,-0.96,-3.1520190568775743
Cc1ccc(NC(=O)N[C@H]2CCC[C@@H]2O)cc1,C06922965_decoy,WEE1,Decoy,0.0,-7.24174,-8.01,-1.63,-7.237988164527856
C/C(=N/NC(N)=O)c1cc(C)c(C)cc1C,C08764093_decoy,WEE1,Decoy,0.0,-6.01992,-7.52,-0.52,-6.620367312698606
Cc1cc(S(C)(=O)=O)c(Br)cc1NN,C15443548_decoy,WEE1,Decoy,0.0,-6.80345,-6.82,-1.32,-8.689332964588859
NC(=O)N/N=C\[C@@H]1CCc2ccccc2C1,C08652381_decoy,WEE1,Decoy,0.0,-6.61915,-6.66,-0.43,-9.082815985300426
NNC(=O)c1ccc(-c2ccc(F)cc2)o1,C09434568_decoy,WEE1,Decoy,0.0,-5.83047,-7.74,0.66,-6.346174575871472
C/C(=N\NC(N)=O)[C@@]12CCCC=C1CCCC2,C17157642_decoy,WEE1,Decoy,0.0,-6.84687,-4.46,-2.6,-2.60930404866839
Nc1nc(-c2c[nH]nc2-c2ccc(F)cc2)cs1,C19336442_decoy,WEE1,Decoy,0.0,-7.8748,-6.97,-1.2,-6.68979935567181
Nc1ccccc1NC(=O)[C@H]1Cc2ccccc2O1,C19403735_decoy,WEE1,Decoy,0.0,-7.25026,-8.74,-0.18,-7.301764963408576
C[C@H]1Cc2ccccc2N1c1ccc(/C(N)=N/O)cc1,C19865765_decoy,WEE1,Decoy,0.0,-7.08933,-8.49,-0.54,-6.627471532523255
[NH3+][N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1,C34955919_decoy,WEE1,Decoy,0.0,-6.53475,-7.38,-3.66,-4.254708169453299
NNc1ccc(N2CCCc3ccccc32)cn1,C36221439_decoy,WEE1,Decoy,0.0,-7.82446,-7.16,-2.04,-6.360078955233839
C[C@H]1CCCCN1c1ccc(/C(N)=N/O)cc1F,C36887631_decoy,WEE1,Decoy,0.0,-7.5757,-4.79,-0.73,-4.556094344429931
Nc1c(F)cccc1NC1CCS(=O)(=O)CC1,C37419867_decoy,WEE1,Decoy,0.0,-7.56985,-4.26,-1.61,-3.499542049397136
Cc1cc(NC(=O)NC(C)(C)C)ccc1C#CCO,C37551626_decoy,WEE1,Decoy,0.0,-6.50596,-7.25,-1.59,-5.479331241108456
Oc1ccccc1[C@H]1CC[C@]2(C1)[C@H](O)CCCN2O,C39510498_decoy,WEE1,Decoy,0.0,-7.53738,-4.91,-1.66,-3.95889000859236
Oc1ccccc1N1CCC[C@H](O)[C@@]12CC[C@H](O)C2,C39511810_decoy,WEE1,Decoy,0.0,-7.97885,-4.56,-1.1,-3.5099900389206
Oc1ccccc1N1[C@@H](O)CCC[C@@]12CCC[C@H](O)C2,C39521343_decoy,WEE1,Decoy,0.0,-7.52942,-6.99,-5.62,-3.085032609919028
Nc1c[nH]c(C(=O)N2CCC[C@@H](C(F)(F)F)C2)c1,C40306655_decoy,WEE1,Decoy,0.0,-5.31963,-7.44,-0.06,-6.033577203904728
Cc1cccc(C(=O)N2CCC[C@H]2c2ccc[nH]2)c1N,C40329503_decoy,WEE1,Decoy,0.0,-5.87293,-4.2,-0.76,-3.4376082453443693
C[C@H]1CCN(c2cc3c(cc2N)CCC(=O)N3)C1,C40717757_decoy,WEE1,Decoy,0.0,-6.70483,-8.65,-1.52,-5.611149094103243
Cc1n[nH]c(Sc2ccc(Cl)cc2N)n1,C41062467_decoy,WEE1,Decoy,0.0,-8.1803,-6.79,-2.6,-7.265229016867915
Cc1cc(-c2nc(N)sc2C)cc2c1NC(=O)CC2,C41629223_decoy,WEE1,Decoy,0.0,-8.8667,-9.7,-0.55,-6.631993707897288
CNC(=O)[C@H]1CCCN1c1ccc(N)c(C)c1,C42393315_decoy,WEE1,Decoy,0.0,-6.86937,-8.21,-1.24,-12.45490424288076
Nc1n[nH]c2nc(C3CC3)c(Br)cc12,C43827430_decoy,WEE1,Decoy,0.0,-6.78657,-7.79,0.03,-8.03359376039544
CC1=N[C@](C)(c2ccc(N)cc2)N(O)C1(C)C,C44579450_decoy,WEE1,Decoy,0.0,-7.85476,-5.83,-0.92,-3.86605782603139
CC(=O)Nc1cc(N2CCC(C)CC2)c(N)cc1Cl,C45891710_decoy,WEE1,Decoy,0.0,-8.15834,-8.0,-0.77,-7.684578182239071
C[C@@H]1CCC[C@H](NC(=O)NC2CCC(O)CC2)C1,C47633599_decoy,WEE1,Decoy,0.0,-7.65756,-5.73,-4.99,-3.1473077398443494
CCN1C(=[NH2+])[C@@H](c2ccc3c(c2)CCO3)[NH+]=C1C,C50986407_decoy,WEE1,Decoy,0.0,-6.10958,-5.21,-2.4,-3.265617578694445
NNc1nc(C2CC2)nc2sc3c(c12)CCC3,C51151403_decoy,WEE1,Decoy,0.0,-8.08533,-7.83,-1.43,-7.271646539755173
CNC(=O)C1CCN(c2cc(F)ccc2N)CC1,C52120585_decoy,WEE1,Decoy,0.0,-7.71064,-7.86,-1.89,-6.495880450451374
C[C@@H]1C[C@H]1Nc1cc2c(cc1N)OCCO2,C52273709_decoy,WEE1,Decoy,0.0,-7.13483,-6.45,0.55,-5.936308496689647
Cc1ccc(NN)c(C(=O)N2CCCC[C@H]2C)c1,C53007031_decoy,WEE1,Decoy,0.0,-6.88934,-7.5,-1.4,-6.884787517812428
Cc1ccc(-n2c([C@H](C)O)nc3cc(N)ccc32)c(F)c1,C53735886_decoy,WEE1,Decoy,0.0,-6.08347,-4.46,-1.12,-3.30264899062007
Cc1ccc(F)c(-n2c([C@@H](C)O)nc3cc(N)ccc32)c1,C53735903_decoy,WEE1,Decoy,0.0,-8.23576,-4.97,-2.32,-5.074934361618572
Cc1cc(F)ccc1-n1c([C@@H](C)O)nc2cc(N)ccc21,C53736021_decoy,WEE1,Decoy,0.0,-8.1793,-4.67,-0.55,-4.474886518981696
C[C@H]1CCN(C(=O)c2cccc(F)c2NN)[C@H](C)C1,C54217679_decoy,WEE1,Decoy,0.0,-5.83279,-7.93,-1.85,-6.523222732873899
Cc1ccc(-c2cc(N)n([C@@H]3CCC[C@@H]3O)n2)cc1,C54599737_decoy,WEE1,Decoy,0.0,-7.83419,-8.66,-2.0,-7.2676705699746496
Cc1nn([C@H]2CCCC[C@H]2O)c(N)c1Br,C54599876_decoy,WEE1,Decoy,0.0,-6.94559,-7.83,-0.62,-6.364863255885153
CC(C)(C)c1cc(N)n([C@@H]2CCCC[C@@H]2O)n1,C54600177_decoy,WEE1,Decoy,0.0,-6.45687,-4.73,-1.0,-3.3219672192258285
Nc1nc(-c2nc3cc(F)c(F)cc3[nH]2)cs1,C55176749_decoy,WEE1,Decoy,0.0,-7.1563,-7.53,-0.07,-5.467156023962622
N/C(=N\O)c1ccc(N2CCC[C@@H]3CCCC[C@@H]32)cc1,C57619999_decoy,WEE1,Decoy,0.0,-7.75201,-5.58,-1.71,-3.8254742333124727
CC1=N[C@@H](N(C)C2CCC(C)CC2)C(N)=[NH+]1,C59041396_decoy,WEE1,Decoy,0.0,-6.8468,-5.14,-0.31,-3.446692719401733
C[C@@H]1CCCN(c2ccc(/C(N)=N/O)cc2)[C@@H]1C,C60117360_decoy,WEE1,Decoy,0.0,-7.33464,-4.25,-1.06,-4.103291305596601
Cn1cc(N)cc1C(=O)Nc1cc(F)c(F)cc1F,C61092752_decoy,WEE1,Decoy,0.0,-6.51447,-8.43,-0.77,-6.507398503237984
Nc1cc(F)c(F)cc1-c1n[nH]c(C2CC2)n1,C61564084_decoy,WEE1,Decoy,0.0,-6.31512,-8.45,-0.74,-6.050776214554948
Cc1ccc(N)c(NC(=O)C2CCOCC2)c1C,C61671015_decoy,WEE1,Decoy,0.0,-6.85785,-8.67,-2.36,-10.966544135503849
Nc1c(N2CC[C@@H](O)C2)ccc2scnc12,C61709392_decoy,WEE1,Decoy,0.0,-7.23448,-7.34,-0.48,-10.559606532823368
C[C@H]1CCC[C@H](C)N1C(=O)c1cc(F)c(NN)c(F)c1,C63007526_decoy,WEE1,Decoy,0.0,-7.50738,-4.76,-1.74,-4.946745218814583
C[C@@]12CCC(=O)C=C1CC[C@H]1[C@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO,C04546270_decoy,WEE1,Decoy,0.0,-9.56504,-6.29,-3.39,-3.265506067794908
C[C@@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,C05275965_decoy,WEE1,Decoy,0.0,-7.04813,-5.61,-4.04,-3.616181954475766
NC(=O)[C@H]1CCc2sc(NC(=O)c3ccc(F)cc3)nc21,C09131709_decoy,WEE1,Decoy,0.0,-7.52299,-8.91,-0.46,-11.390630776624151
C[C@]12C[C@@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]43C)[C@@H]1CC[C@@]2(O)C(=O)CO,C11592558_decoy,WEE1,Decoy,0.0,-9.39492,-4.85,-2.09,-5.367186574549141
C[C@]12C[C@@H](O)[C@@H]3[C@@H](CCC4=CC(=O)C=C[C@]43C)[C@@H]1CC[C@@]2(O)C(=O)CO,C11592735_decoy,WEE1,Decoy,0.0,-7.66279,-5.08,-1.89,-3.937437673276015
CCCc1[nH]nc2c1[C@H](c1ccsc1C)C(C#N)=C(N)O2,C09088922_decoy,WEE1,Decoy,0.0,-7.51938,-4.8,-0.32,-3.926109382400449
C=CCn1c(=S)[nH]c([O-])c([C@H]2[NH2+]CCc3ccccc32)c1=O,C20150101_decoy,WEE1,Decoy,0.0,-8.66527,-4.39,-1.62,-4.708420026604398
NNC(=O)c1cccn2cc(-c3ccc(Br)cc3)nc12,C22996585_decoy,WEE1,Decoy,0.0,-8.1158,-7.69,-0.41,-7.38630476982814
CC(C)(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1Br,C36721865_decoy,WEE1,Decoy,0.0,-8.25054,-7.43,-4.18,-4.7896610040748255
NS(=O)(=O)c1ccc(NC(=O)c2c(F)cccc2F)cc1,C36719804_decoy,WEE1,Decoy,0.0,-7.26551,-8.96,-1.42,-12.043258743372068
Cc1ccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)c(N)c1,C37064630_decoy,WEE1,Decoy,0.0,-6.88412,-9.72,-0.86,-12.775730184330298
[NH3+]CC#Cc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)cn1,C37581870_decoy,WEE1,Decoy,0.0,-7.44752,-4.81,-3.92,-4.362213130807654
C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,C03977925_decoy,WEE1,Decoy,0.0,-8.80318,-5.12,-1.37,-4.4348008441377775
C[C@@]12CCC(=O)C=C1CC[C@H]1[C@@H]2[C@H](O)C[C@]2(C)[C@@H]1CC[C@]2(O)C(=O)CO,C03872834_decoy,WEE1,Decoy,0.0,-7.2509,-5.53,-1.53,-4.021094212455926
NS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccc(F)cc2)c1,C38104559_decoy,WEE1,Decoy,0.0,-8.43186,-8.44,-1.28,-8.440485942825365
NC(=O)c1ccsc1NC(=O)c1ccc(Br)o1,C38828367_decoy,WEE1,Decoy,0.0,-8.34399,-7.05,0.3,-6.907387270103557
Cc1cc(N)cc(S(=O)(=O)N2CCC[C@H]2c2ccc[nH]2)c1,C40333803_decoy,WEE1,Decoy,0.0,-7.74335,-4.29,-2.65,-5.039332361664372
NS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccsc2)c1,C40378769_decoy,WEE1,Decoy,0.0,-9.27923,-8.25,-1.74,-8.516058140188248
NS(=O)(=O)c1ccc(Cl)c(NC(=O)[C@H]2C[C@@H]3C=C[C@H]2C3)c1,C40378799_decoy,WEE1,Decoy,0.0,-9.02293,-5.5,-1.74,-4.78547575479274
Nc1cncc(C(=O)N2CCC[C@@H]2c2c[nH]c3cccc(F)c23)c1,C40820496_decoy,WEE1,Decoy,0.0,-7.17473,-5.28,-1.18,-4.735631055859058
C[C@]12C[C@@H](O)[C@@H]3[C@H](CCC4=CC(=O)C=C[C@]43C)[C@@H]1CC[C@@]2(O)C(=O)CO,C44460423_decoy,WEE1,Decoy,0.0,-7.88146,-4.85,-2.15,-4.247341956376394
CC(C)c1[nH]nc2c1[C@@H](c1ccc(F)c(F)c1)C(C#N)=C(N)O2,C39326135_decoy,WEE1,Decoy,0.0,-7.26151,-5.03,-1.66,-4.386395249803593
NC(=O)N[C@H]1CCCN(C(=O)c2cc(Cl)sc2Cl)C1,C49519797_decoy,WEE1,Decoy,0.0,-8.70306,-8.43,-1.1,-7.943093159578914
C[C@@H](O)c1ccc(NC(=O)Nc2nc3c(s2)CCC3)cc1,C49549400_decoy,WEE1,Decoy,0.0,-7.98037,-9.42,0.2,-8.057584859190458
CCN1C=[NH+][C@@H](c2cc(Br)c3c(c2)OCCO3)C1=[NH2+],C50121735_decoy,WEE1,Decoy,0.0,-7.52344,-7.35,-0.49,-6.412973022523587
Nc1c(C2CC2)n[nH]c1C(=O)N1CCC[C@H](C(F)(F)F)C1,C50323987_decoy,WEE1,Decoy,0.0,-6.36275,-7.42,-2.3,-6.797535191202668
NNc1ccc(Cl)cc1C(=O)N1CCO[C@H]2CCCC[C@@H]21,C51124247_decoy,WEE1,Decoy,0.0,-7.141,-8.07,-4.44,-4.8959514634959485
NNc1nc(-c2ccncc2)nc2sc3c(c12)CCCC3,C51151381_decoy,WEE1,Decoy,0.0,-9.11304,-8.82,-0.49,-7.551352801047698
Nc1cc2c(cc1NC(=O)c1ccc(Cl)s1)OCO2,C51171108_decoy,WEE1,Decoy,0.0,-8.2097,-8.73,-0.04,-7.914248829700351
N#CC1=C(N)Oc2[nH]nc(C(F)(F)F)c2[C@H]1c1ccccc1,C00076371_decoy,WEE1,Decoy,0.0,-6.85358,-9.95,0.2,-7.796389561186666
Nc1ccc(S(=O)(=O)N[C@H]2CCc3ccccc3C2)cn1,C51634148_decoy,WEE1,Decoy,0.0,-7.99421,-8.31,-1.86,-7.398976395880547
Nc1cc(S(=O)(=O)N[C@H]2CCc3ccccc3C2)ccn1,C51634160_decoy,WEE1,Decoy,0.0,-7.33747,-8.15,-1.93,-7.161079252641674
O=S(=O)(N[C@@H]1CCCC[C@H]1O)c1ccc2c(c1)CCCN2,C52010982_decoy,WEE1,Decoy,0.0,-8.75393,-8.71,-1.52,-7.5332310036386145
O=c1[nH]c2cc(Br)c([C@H](O)[C@H]3CCCCO3)cc2[nH]1,C52094937_decoy,WEE1,Decoy,0.0,-7.19031,-7.24,-0.21,-7.511617855218508
Nc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(Cl)c2)c[nH+]1,C50633810_decoy,WEE1,Decoy,0.0,-8.63897,-6.98,-0.7,-7.706101930683646
Nc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(Cl)c2)cc[nH+]1,C50634026_decoy,WEE1,Decoy,0.0,-9.11425,-8.17,-1.36,-8.366987702065769
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)[C@H]1C[C@@H]1c1ccc(F)cc1,C22018784_decoy,WEE1,Decoy,0.0,-7.18926,-7.15,-0.49,-5.680393048116841
N/C(=N/O)c1nccnc1Sc1ccc(Br)cc1,C54396367_decoy,WEE1,Decoy,0.0,-8.6818,-4.53,-1.33,-4.231849572203014
O=C(N[C@H]1CCOc2ccccc21)N[C@@H]1c2ccccc2C[C@@H]1O,C57003558_decoy,WEE1,Decoy,0.0,-8.82776,-9.32,-1.37,-8.125035500119814
CC(C)c1[nH]nc2c1[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2,C04453376_decoy,WEE1,Decoy,0.0,-6.98508,-4.84,0.4,-3.7641610038953344
NC(=O)NC(=O)[C@H](c1ccccc1)N1CC[C@@H]2CCCC[C@@H]2C1,C52710237_decoy,WEE1,Decoy,0.0,-7.79354,-8.22,-5.74,-5.519699784016544
Nc1ncccc1S(=O)(=O)N[C@H]1CCCc2sccc21,C61373365_decoy,WEE1,Decoy,0.0,-7.90694,-4.64,-0.6,-5.0541453143686
[NH3+]CC#Cc1ccc(Cl)c([N-]S(=O)(=O)N2CCCCC2)c1,C61692112_decoy,WEE1,Decoy,0.0,-8.2258,-7.3,-2.86,-7.518299485606904
N/C(=N/O)c1ccc(Cl)cc1N1CCO[C@@H]2CCC[C@@H]21,C62789514_decoy,WEE1,Decoy,0.0,-7.63756,-4.64,-0.29,-3.682353837243027
N/C(=N/O)c1ccc(N2CCO[C@@H]3CCCC[C@@H]32)c(Cl)c1,C62794671_decoy,WEE1,Decoy,0.0,-8.86126,-7.74,-0.94,-6.733865361089297
O=C([O-])c1cccc(Br)c1NC(=O)[C@H]1CCC[NH2+]1,C62826859_decoy,WEE1,Decoy,0.0,-6.29934,-6.98,0.05,-6.642319432038134
NC(=O)[C@H]1CCN(C(=O)NC[C@H]2CCCc3ccccc32)C1,C46938544_decoy,WEE1,Decoy,0.0,-7.14089,-6.75,-2.68,-6.655329277455695
NC(=O)[C@@H]1CCN(C(=O)NC[C@H]2CCCc3ccccc32)C1,C46938548_decoy,WEE1,Decoy,0.0,-7.80149,-8.36,-4.4,-6.565841379630485
NC(=O)Nc1cccc(C(=O)N2CC3C[C@@H]4CC2C[C@H](C3)C4)c1,C65924952_decoy,WEE1,Decoy,0.0,-6.20326,-11.18,-3.4,-9.719102206019125
CNC(=O)c1c(C)nc(N)nc1-c1ccc(C(C)(C)C)cc1,C66135911_decoy,WEE1,Decoy,0.0,-6.76998,-7.57,-0.91,-6.835378690631153
CC1(C)Oc2nc(N)nc(N)c2[C@H]1c1ccc(Cl)cc1,C01555890_decoy,WEE1,Decoy,0.0,-7.70838,-4.77,-1.01,-4.336814005337784
CSc1nc(N)c2nc(-c3ccccc3)c(N)nc2n1,C01631335_decoy,WEE1,Decoy,0.0,-7.54183,-9.5,-0.15,-9.808748410978676
C[C@@H]1c2nc(N)nc(N)c2CN1C(=O)c1cc(Cl)cc(Cl)c1,C00041317_decoy,WEE1,Decoy,0.0,-9.06593,-9.24,-0.34,-8.160293759433932
Nc1nc(N)c2sc3nc4c(cc3c2n1)CCCCC4,C00293613_decoy,WEE1,Decoy,0.0,-7.90673,-8.15,0.71,-5.436923381959181
Nc1ccc2nc(NC(=O)Nc3ccc(F)cc3)sc2c1,C21799089_decoy,WEE1,Decoy,0.0,-7.04153,-9.66,-0.83,-10.614260211545336
CC(=O)Nc1cccc(NC(=O)c2ccc(F)c(N)c2)c1,C32134091_decoy,WEE1,Decoy,0.0,-7.2177,-9.36,-0.91,-11.454266071588968
Cc1ccc([C@H]2C(C#N)=C(N)Oc3nc(N)sc32)cc1,C27825402_decoy,WEE1,Decoy,0.0,-8.01238,-6.34,-0.57,-5.660238377755824
Cc1ccc(C(=O)Nc2cc3c(cc2N)OCO3)cc1O,C36737146_decoy,WEE1,Decoy,0.0,-7.08897,-10.15,-1.15,-11.01419048487971
Cc1ccc(NC(=O)C/C(N)=N/O)c(Br)c1,C36929703_decoy,WEE1,Decoy,0.0,-7.10841,-8.57,-0.12,-7.111591266138793
NC(=O)Nc1ccc(NC2CCC3(CC2)OCCO3)cc1,C37136564_decoy,WEE1,Decoy,0.0,-7.18378,-8.94,-0.78,-6.97277611100284
Nc1ccc(SCc2nc(N)c3ccccc3n2)nc1,C37191421_decoy,WEE1,Decoy,0.0,-8.30827,-4.41,-0.3,-4.618454551793277
CNC(=O)NC(=O)[C@H](C)Sc1ccc(Br)cc1N,C37205715_decoy,WEE1,Decoy,0.0,-7.46166,-6.66,-1.95,-6.53134249758386
CN(c1ccc(S(N)(=O)=O)cc1N)C1CCCCC1,C37333544_decoy,WEE1,Decoy,0.0,-8.41271,-8.14,-0.82,-10.870276099411582
Cc1sc2nc([C@@H](C)Sc3n[nH]c(N)n3)[nH]c(=O)c2c1C,C13598343_decoy,WEE1,Decoy,0.0,-9.42985,-8.59,0.18,-14.351874632961076
Nc1cc(N2CCC[C@@H]3CCCC[C@@H]32)cc(S(N)(=O)=O)c1,C37934304_decoy,WEE1,Decoy,0.0,-9.90865,-9.3,-2.33,-9.228294668145203
Nc1cc2c(cc1NC(=O)Nc1cccc(F)c1)OCO2,C38076220_decoy,WEE1,Decoy,0.0,-7.00166,-9.03,-3.97,-7.363349880694379
Nc1c[nH]c(C(=O)Nc2ccc(N3CCCCC3)cc2)c1,C40313686_decoy,WEE1,Decoy,0.0,-6.78655,-8.75,-0.11,-12.554509625236008
N/C(=N/O)c1cccc(NC(=O)c2ccc(Br)cc2)c1,C40369114_decoy,WEE1,Decoy,0.0,-7.44883,-9.52,-1.02,-7.041597529848853
Nc1cc(N)nc(SC[C@H]2COc3ccccc3O2)n1,C40414856_decoy,WEE1,Decoy,0.0,-8.46748,-7.47,-1.01,-6.705890772901161
Nc1ncnc(N2CCC(Cc3ccccc3)CC2)c1N,C40723738_decoy,WEE1,Decoy,0.0,-7.68814,-7.0,-1.43,-7.32897132861989
C[C@H]1[C@H](n2nnnc2-c2ccc(N)cc2N)CCC[C@@H]1C,C42016669_decoy,WEE1,Decoy,0.0,-7.36958,-8.32,-2.2,-6.937518925584644
Nc1cc(N)cc(-c2nnnn2-c2ccc(Br)cc2)c1,C42027150_decoy,WEE1,Decoy,0.0,-7.23782,-8.23,-1.45,-6.681338602985972
CC1CCC(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2C3)(/C(N)=N/O)CC1,C42175794_decoy,WEE1,Decoy,0.0,-7.04878,-4.69,-1.37,-5.461028155534632
C[C@@H]1CC[C@@H](C(N)=O)CN1c1ccc2scnc2c1N,C42427718_decoy,WEE1,Decoy,0.0,-8.35802,-7.36,-0.18,-10.234699340923564
NC(=O)Nc1cccc(NC(=O)c2c(F)cccc2F)c1,C42620557_decoy,WEE1,Decoy,0.0,-7.38748,-8.99,-1.73,-7.020598262194222
C[C@H]1CCCC[C@H]1CNc1cc2c(cc1N)OCC(=O)N2,C42860081_decoy,WEE1,Decoy,0.0,-7.91191,-6.72,-1.54,-7.614773680251504
N#Cc1cc2c(nc1Sc1nc(N)cc(N)n1)CCCC2,C43410347_decoy,WEE1,Decoy,0.0,-9.16604,-8.74,-0.97,-9.186401515830978
NC(=S)c1ccc(Cn2cnc3c(N)ncnc32)cc1,C43461219_decoy,WEE1,Decoy,0.0,-7.21142,-7.49,-0.29,-6.448207630719525
Cc1cc(C)cc(NC(=O)C2(/C(N)=N/O)CCCCC2)c1,C44784440_decoy,WEE1,Decoy,0.0,-8.19717,-5.6,-1.01,-5.014153795625893
C[C@@H](C(=O)Nc1c(F)cc(F)cc1Br)/C(N)=N/O,C44866120_decoy,WEE1,Decoy,0.0,-7.9596,-8.98,-2.0,-9.45404927400934
[NH3+][C@H]1CCCN(C(=O)Nc2cc(Br)ccc2C(=O)[O-])C1,C48837294_decoy,WEE1,Decoy,0.0,-7.20714,-8.16,-0.33,-8.206163471010736
CC[C@@H]1CCCC[C@@H]1n1nnnc1-c1ccc(N)cc1N,C49122184_decoy,WEE1,Decoy,0.0,-7.14046,-9.24,-0.88,-9.820951298233968
CC[C@@H]1CCCC[C@H]1n1nnnc1-c1cc(N)cc(N)c1,C49122202_decoy,WEE1,Decoy,0.0,-7.28,-9.12,-2.23,-7.725529290012811
O=C(NNc1ccc(F)cc1Br)Nc1cn[nH]c1,C49212153_decoy,WEE1,Decoy,0.0,-6.68724,-6.2,-1.3,-5.841026640929607
Cc1ccc(N(C)c2ccc(S(N)(=O)=O)cc2N)cc1,C50002940_decoy,WEE1,Decoy,0.0,-7.37098,-8.79,-2.09,-7.699809862023238
Cc1[nH]nc(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)c1N,C50305476_decoy,WEE1,Decoy,0.0,-6.49583,-8.84,-0.07,-14.015480493811063
CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)c1N,C50321138_decoy,WEE1,Decoy,0.0,-6.82001,-5.78,-3.05,-4.737280214083585
NNc1ncccc1C(=O)Nc1cccc2c1CCCC2,C51089847_decoy,WEE1,Decoy,0.0,-8.61009,-4.74,-0.87,-4.477438813277341
NNc1ccc(C(=O)Nc2ccc(Br)cc2F)nn1,C51090094_decoy,WEE1,Decoy,0.0,-7.19286,-8.63,0.22,-9.308343738276465
Cc1nc(NC(=O)c2cc(Cl)nc(NN)c2)sc1C,C51125003_decoy,WEE1,Decoy,0.0,-8.80344,-6.65,-2.62,-7.710251889813865
COc1cc(-c2nc3c(c(NN)n2)CCCC3)ccc1O,C51168953_decoy,WEE1,Decoy,0.0,-9.19127,-8.58,-1.23,-7.942087786656844
NNc1ccc(C(=O)N[C@H]2CCc3ccccc3C2)cn1,C51634303_decoy,WEE1,Decoy,0.0,-7.05422,-5.11,-0.84,-4.157037070297674
Cc1c(N)cccc1S(=O)(=O)N[C@@H]1CCCC[C@H]1O,C51993352_decoy,WEE1,Decoy,0.0,-7.52663,-8.25,-0.89,-7.434361401785773
C[C@@H](C1CCCCC1)n1nnnc1-c1cc(N)cc(N)c1,C52342156_decoy,WEE1,Decoy,0.0,-7.69411,-8.41,-2.34,-8.646960648855655
Nc1nc(Cl)cc(NC2[C@@H]3CCC[C@H]2C[NH+](C2CC2)C3)n1,C54982236_decoy,WEE1,Decoy,0.0,-7.99228,-5.7,-0.81,-4.405574022917757
Cc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2C(N)=S,C58900026_decoy,WEE1,Decoy,0.0,-8.15158,-9.36,0.03,-10.457157615215433
N/C(=N/O)[C@H]1CCC[C@@H]1NC(=O)c1cc2c(s1)CCC2,C61886294_decoy,WEE1,Decoy,0.0,-9.09205,-4.74,-1.07,-5.231695494162458
N/C(=N/O)C1(NC(=O)c2cscn2)CCCCCC1,C62361553_decoy,WEE1,Decoy,0.0,-8.08787,-4.22,0.0,-4.540586486720771
Cc1cc([O-])nc(Sc2ccc(C(N)=[NH2+])cc2Cl)n1,C62794835_decoy,WEE1,Decoy,0.0,-9.86181,-8.18,-0.33,-8.489422085723675
CC1CCC(Cn2nnnc2-c2ccc(N)cc2N)CC1,C63146597_decoy,WEE1,Decoy,0.0,-6.8453,-8.86,-0.08,-14.06108478070907
NC(=O)c1c(NC(=O)C2CCCCC2)sc2c1CCCC2,C00038517_decoy,WEE1,Decoy,0.0,-9.04262,-8.62,-0.3,-8.76656330151065
Cc1ccc(-n2c(N)c(C(=O)NC(C)C)sc2=S)c(C)c1,C03320340_decoy,WEE1,Decoy,0.0,-8.85281,-7.18,-0.72,-7.945089046637274
NC(=O)c1c(NC(=O)C2CCC2)sc2c1CCCCCC2,C02762599_decoy,WEE1,Decoy,0.0,-8.02287,-8.56,-3.65,-7.837285306656563
C[C@@H]1CC[C@H]2[C@](C)(CO)[C@@H](O)CC[C@]2(C)[C@@]12CC[C@](C)(CO)O2,C04081366_decoy,WEE1,Decoy,0.0,-8.27252,-5.25,-3.06,-3.931451024591984
C[C@@H]1CC[C@@H]2[C@](C)(CO)[C@@H](O)CC[C@]2(C)[C@@]12CC[C@](C)(CO)O2,C04081367_decoy,WEE1,Decoy,0.0,-7.96033,-5.34,-2.64,-4.66767864415219
[H]/N=C1/SC(N)=C(C#N)[C@H](c2cc(Br)c(C)s2)[C@H]1C#N,C02058397_decoy,WEE1,Decoy,0.0,-9.13747,-4.15,-0.29,-3.7949485788158586
C[C@H](O)[C@@H]1[C@@H](O)C[C@H]2[C@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC(=O)[C@]12C,C07041666_decoy,WEE1,Decoy,0.0,-8.77532,-6.55,-1.98,-5.173096979551032
NC(=O)c1c(NC(=O)[C@@H]2C[C@@H]3CC[C@H]2C3)sc2c1CCCC2,C12379053_decoy,WEE1,Decoy,0.0,-8.43276,-4.74,0.0,-4.897237712222018
C=C(CO)[C@@]1(O)CC[C@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@@]21C,C12657090_decoy,WEE1,Decoy,0.0,-8.03008,-4.98,-3.2,-2.691890266995117
CC(=O)[C@@H]1CC[C@@H]2[C@@H]3CC[C@H]4C[C@@H](O)C[C@@H](O)[C@@]4(C)[C@@H]3[C@H](O)C[C@@]21C,C19910765_decoy,WEE1,Decoy,0.0,-8.24405,-5.97,-5.38,-2.582168044406675
Nc1cc(F)ccc1S(=O)(=O)Nc1ccc(Cl)cc1,C19979766_decoy,WEE1,Decoy,0.0,-6.58857,-7.85,-1.35,-8.295222785196723
CC1CCC(NS(=O)(=O)c2ccc(Cl)cc2N)CC1,C21020606_decoy,WEE1,Decoy,0.0,-7.10943,-7.51,-3.26,-6.880560992184568
Cc1csc(C2=C(N)NC(SC(C)C)=C(C#N)C23CCCCC3)n1,C11394997_decoy,WEE1,Decoy,0.0,-7.66007,-5.01,-1.33,-4.949795589638921
[H]/N=C1/SC(N)=C(C#N)[C@H](c2c(Cl)cccc2Cl)[C@@H]1C#N,C04095454_decoy,WEE1,Decoy,0.0,-8.53552,-5.8,-1.05,-4.077125319123274
Cc1cc(Br)cc(C)c1NC(=O)c1cc(N)cn1C1CC1,C36862334_decoy,WEE1,Decoy,0.0,-8.23639,-8.18,-2.07,-7.615984155327552
Nc1ccc(F)cc1C(=O)Nc1ccc(Br)cn1,C36882916_decoy,WEE1,Decoy,0.0,-6.89658,-7.89,-0.88,-6.400950665649163
Cc1ccc(NS(=O)(=O)c2c(C)ccc(N)c2C)cc1C,C37055686_decoy,WEE1,Decoy,0.0,-6.65495,-7.36,-1.59,-6.2469073015752485
NS(=O)(=O)c1cccc(N[C@@H]2CCc3ccccc3C2)c1,C37201062_decoy,WEE1,Decoy,0.0,-8.34136,-8.56,-1.69,-7.590788347125773
NS(=O)(=O)c1cccc(N[C@H]2CSCc3ccccc32)c1,C37201089_decoy,WEE1,Decoy,0.0,-9.28603,-6.53,-2.11,-7.091078589214016
C[C@H]1CCCN(c2ccc(/C(N)=N/O)c(C(F)(F)F)c2)C1,C37306742_decoy,WEE1,Decoy,0.0,-6.86391,-8.97,-0.86,-6.965867610909054
C[C@@H]1CCCCN1c1ccc(C(F)(F)F)cc1/C(N)=N/O,C37334558_decoy,WEE1,Decoy,0.0,-7.57708,-7.2,-1.83,-5.951785185047692
Cc1cc(C(F)(F)F)c2c(N)c(C(=O)NC3CC3)sc2n1,C00495370_decoy,WEE1,Decoy,0.0,-7.45179,-8.62,-0.8,-8.099316448466398
Cc1cc(F)ccc1NS(=O)(=O)c1c(F)cc(N)cc1F,C37928293_decoy,WEE1,Decoy,0.0,-7.59785,-8.78,-1.54,-10.808182224404831
C[C@@H]1[C@@H](C)CCC[C@H]1NS(=O)(=O)c1cc(F)ccc1N,C37928986_decoy,WEE1,Decoy,0.0,-7.67507,-6.72,-3.8,-3.802047453491828
Nc1ccc2c(c1)N(C(=O)Nc1ccc(F)cc1)CCS2,C38051342_decoy,WEE1,Decoy,0.0,-6.4208,-5.23,-1.96,-4.078873219579805
Cc1sc(NC(=O)c2ccc(Cl)cc2N)c(C#N)c1C,C40313382_decoy,WEE1,Decoy,0.0,-7.90395,-8.82,-0.5,-10.991083095125775
Cc1cc(Cl)ccc1NS(=O)(=O)c1cc(N)cs1,C41067825_decoy,WEE1,Decoy,0.0,-7.12572,-4.43,-2.28,-3.3934373980673294
CNC(=O)[C@@H]1CCCCN1c1ccc(C(F)(F)F)cc1N,C42420884_decoy,WEE1,Decoy,0.0,-6.35767,-5.41,-1.16,-3.697824813000008
N/C(=N/O)c1cc2c(nc1SC1CCCCC1)CCCC2,C43410725_decoy,WEE1,Decoy,0.0,-9.57029,-8.34,-0.58,-7.877326622874111
C=C(CO)[C@]1(O)CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@@]4(C)[C@@H]3[C@H](O)C[C@]21C,C43736330_decoy,WEE1,Decoy,0.0,-9.15849,-6.62,-1.29,-4.510502825627996
C[C@@H]1CC[C@@H]2[C@](C)(CO)[C@@H](O)CC[C@@]2(C)[C@@]12CC[C@](C)(CO)O2,C43743110_decoy,WEE1,Decoy,0.0,-8.49061,-5.09,-2.08,-3.7728736474908287
CC(=O)[C@@H]1CC[C@H]2[C@H]3CC[C@@H]4C[C@@H](O)C[C@@H](O)[C@]4(C)[C@@H]3[C@H](O)C[C@]12C,C44460416_decoy,WEE1,Decoy,0.0,-8.02534,-5.11,-3.34,-3.838640811398701
C[C@H](NC(=O)c1cc(Br)cnc1N)c1cccs1,C50702236_decoy,WEE1,Decoy,0.0,-8.20735,-7.1,-0.54,-13.740383796387563
Nc1csc(S(=O)(=O)N[C@H]2CCc3ccccc3C2)c1,C51630720_decoy,WEE1,Decoy,0.0,-7.07194,-7.21,-1.51,-6.654371340745326
Nc1csc(S(=O)(=O)N[C@H]2CCCc3ccccc32)c1,C51630780_decoy,WEE1,Decoy,0.0,-8.88155,-9.29,-1.4,-10.24566278382059
C[C@H]1CCC[C@](CO)(NC(=O)c2cc(Br)c[nH]2)C1,C53104086_decoy,WEE1,Decoy,0.0,-7.7182,-5.39,-1.64,-4.7119674808594665
NNc1nc2c(OC(F)F)cc(Br)cc2s1,C57328249_decoy,WEE1,Decoy,0.0,-6.70906,-6.66,-0.45,-6.116167134331777
O=C(NCC12CC3CC(CC(C3)C1)C2)NC1CCC(O)CC1,C58714719_decoy,WEE1,Decoy,0.0,-8.27532,-8.89,-1.99,-7.870565330550638
Nc1cc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)c(Br)cc1F,C61079993_decoy,WEE1,Decoy,0.0,-7.12063,-9.1,-0.52,-7.784800228088427
NS(=O)(=O)c1cccc(N[C@H]2CCCc3sccc32)c1,C61324571_decoy,WEE1,Decoy,0.0,-7.9445,-6.91,-0.95,-6.6297746416482575
CNC(=O)Nc1ccc(N[C@H]2CCCc3sccc32)cc1,C61327823_decoy,WEE1,Decoy,0.0,-8.09115,-8.82,-0.88,-13.587802048433923
Cc1c(N)cccc1S(=O)(=O)N[C@@H]1CCCc2sccc21,C61360370_decoy,WEE1,Decoy,0.0,-9.20381,-5.08,-0.9,-5.51131349861279
Nc1cc2c(cc1N[C@@H]1CCCc3sccc31)OCCO2,C61360905_decoy,WEE1,Decoy,0.0,-8.19902,-6.79,-1.61,-6.312799708666313
Cc1cc(Br)cc(N)c1NC(=O)c1cscn1,C62353513_decoy,WEE1,Decoy,0.0,-7.44912,-7.95,-0.36,-7.541095494457788
CC(C)c1ccc([C@@H]2Oc3c(N)cc(F)cc3NC2=O)cc1,C62562112_decoy,WEE1,Decoy,0.0,-7.94732,-5.27,-0.1,-4.828737634563611
CC(C)c1cc(N)cc2c1O[C@@H](c1ccc(F)cc1)C(=O)N2,C62562133_decoy,WEE1,Decoy,0.0,-7.54501,-9.87,-0.06,-8.755394060521771
CNC(=O)[C@H]1CCCCN1c1cc(Cl)ccc1C(N)=S,C62788338_decoy,WEE1,Decoy,0.0,-8.96099,-7.64,-2.87,-11.099869130481
CC1(C)CCCN1c1ccc(/C(N)=N/O)c(C(F)(F)F)c1,C63067335_decoy,WEE1,Decoy,0.0,-6.14938,-9.12,-0.88,-9.75975276623374
Nc1nc2c(s1)[C@@H](c1ccc(Br)cc1)CC(O)=N2,C32091766_decoy,WEE1,Decoy,0.0,-8.03542,-8.46,-0.46,-6.802830736981541
Cc1cc(/C=N/NC(N)=S)c(C)n1-c1ccc(Cl)cc1,C08684877_decoy,WEE1,Decoy,0.0,-7.54093,-7.85,-1.61,-6.791158581978099
CN(c1ccc(C(=O)Nc2ccccc2C(=O)[O-])cc1)S(=O)(=O)c1ccccc1,C04724125_decoy,WEE1,Decoy,0.0,-6.57842,-10.39,-2.35,-7.130034204088353
Cc1c(CCC(=O)N[C@@H](C(=O)[O-])C(C)C)c(=O)oc2cc3oc4c(c3cc12)CCCC4,C11865478_decoy,WEE1,Decoy,0.0,-7.27944,-9.08,-3.06,-8.516131712243789
Cc1cc(C)c(C(=O)[O-])c(SCC(=O)N2CC(=O)Nc3cc(C(F)(F)F)ccc32)n1,C13023264_decoy,WEE1,Decoy,0.0,-6.95204,-9.27,-1.31,-13.574466386789952
O=C(COc1ccc(C(=O)[O-])cc1Br)NC[C@H]1COc2ccccc2O1,C13035475_decoy,WEE1,Decoy,0.0,-8.92413,-8.43,-1.0,-8.384116061940642
Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)Nc3cccc(C(=O)[O-])c3)cc2)cc1,C13094789_decoy,WEE1,Decoy,0.0,-9.31022,-5.62,-1.94,-5.285647503678373
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)Nc3cccc(C(=O)[O-])c3)c2)C1,C13094874_decoy,WEE1,Decoy,0.0,-9.36058,-10.53,-1.74,-9.540845213275905
O=C([O-])c1cc(Cl)ccc1NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1,C13187809_decoy,WEE1,Decoy,0.0,-7.98174,-5.85,-3.02,-4.397074350563227
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1,C13258597_decoy,WEE1,Decoy,0.0,-7.85944,-6.13,-1.6,-5.724017627920048
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)Nc2cccc(C(=O)[O-])c2)c1,C13259475_decoy,WEE1,Decoy,0.0,-7.26285,-10.6,-4.65,-7.903335716450663
O=C(Nc1ccccc1C(=O)[O-])c1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1,C13261371_decoy,WEE1,Decoy,0.0,-8.78829,-8.89,-1.93,-7.232656892746648
COC(=O)c1cc(Br)ccc1NS(=O)(=O)c1ccc(F)c(C(=O)[O-])c1,C13262025_decoy,WEE1,Decoy,0.0,-7.92457,-8.31,-2.56,-7.678166774089523
C[C@@H](Sc1ncc(C(=O)[O-])n1-c1ccc(F)cc1)C(=O)NC1(C#N)CCCCC1,C13353572_decoy,WEE1,Decoy,0.0,-7.05278,-8.17,-0.87,-7.530169004482416
Cc1cc(/C=C/C(=O)c2ccc(S(=O)(=O)N3CCCC[C@H]3C(=O)[O-])cc2)cc(C)c1O,C13358367_decoy,WEE1,Decoy,0.0,-9.13925,-9.56,-1.45,-7.978391309535109
Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(C(=O)[O-])cc3C)CC2)cc1,C13390747_decoy,WEE1,Decoy,0.0,-8.17903,-6.26,-1.07,-5.426626083760702
Cc1cc(C(=O)[O-])ccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1,C13391236_decoy,WEE1,Decoy,0.0,-7.63999,-10.09,-1.8,-7.739772509023839
Cc1cc(C(=O)[O-])ccc1NC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1,C13391450_decoy,WEE1,Decoy,0.0,-7.3378,-9.72,-2.6,-7.561786604421917
O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)[O-])C2)cc1)c1csc2c1CCCC2,C13396141_decoy,WEE1,Decoy,0.0,-9.6444,-9.27,-2.27,-8.22944490974617
O=C(Cc1ccc2c(c1)CCC2)Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)[O-])C2)cc1,C13397748_decoy,WEE1,Decoy,0.0,-9.02444,-9.77,-1.36,-11.969868238716105
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)c1,C13402519_decoy,WEE1,Decoy,0.0,-7.13433,-10.09,-1.92,-7.643959173709474
O=C([O-])c1cc2ccccc2cc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1,C13426640_decoy,WEE1,Decoy,0.0,-8.72251,-9.22,-1.95,-8.023060734181843
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)Nc2cc(F)ccc2C(=O)[O-])c1,C13428477_decoy,WEE1,Decoy,0.0,-7.92277,-9.01,-2.81,-5.203253487782285
Cc1cccc(C(=O)[O-])c1NC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1,C13432915_decoy,WEE1,Decoy,0.0,-8.24293,-10.25,-2.8,-9.490321251914176
O=C(COc1cc2ccccc2cc1C(=O)[O-])Nc1cc2c(cc1Br)OCCO2,C13456981_decoy,WEE1,Decoy,0.0,-8.5472,-9.92,-1.42,-9.703688965393924
CC[C@@H](NC(=O)Cc1c(C)c2cc3c(cc2oc1=O)OC1(CCCCC1)CC3)C(=O)[O-],C13629244_decoy,WEE1,Decoy,0.0,-8.98639,-8.86,-1.66,-14.473830918190018
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1,C16400311_decoy,WEE1,Decoy,0.0,-7.62292,-8.49,-2.07,-7.309514386923325
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)c3csc4ccccc34)cc2)no1,C01055753_decoy,WEE1,Decoy,0.0,-7.84617,-8.12,-2.1,-6.469799251993663
O=C([O-])Cc1csc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)n1,C12941110_decoy,WEE1,Decoy,0.0,-7.70111,-7.42,-1.28,-6.542286751194427
COC(=O)c1ccc2c([O-])nc3c(C(=O)NCc4cccs4)sc(=S)n3c2c1,C32946448_decoy,WEE1,Decoy,0.0,-9.37059,-9.31,-1.39,-9.072229292046504
O=C([O-])c1cc(S(=O)(=O)Nc2ccc3c(c2)OCCCO3)ccc1Br,C33048506_decoy,WEE1,Decoy,0.0,-8.38345,-9.29,-1.04,-9.631858526548411
O=C([O-])c1cc(N2CCN(c3ccccc3)CC2)ccc1NS(=O)(=O)c1ccccc1,C33259876_decoy,WEE1,Decoy,0.0,-8.53244,-8.46,-2.34,-7.318769280306119
[S-]c1nnc(-c2[nH]nc3c2CCC3)n1/N=C\c1ccc(OCc2ccccc2)cc1,C01275773_decoy,WEE1,Decoy,0.0,-8.65434,-7.08,-0.95,-8.470021402950376
O=C1NC([S-])=N/C1=C/c1cc(Br)ccc1OCc1ccc([N+](=O)[O-])cc1,C09310310_decoy,WEE1,Decoy,0.0,-8.5011,-6.71,-2.98,-7.4666425617080225
COc1cc(NC(=O)c2ccccc2)cc2sc([N-]S(=O)(=O)c3ccccc3)nc12,C21353397_decoy,WEE1,Decoy,0.0,-8.24712,-8.6,-2.86,-10.19953748916584
Cc1c(C(=O)[O-])cccc1-n1c(C)cc(/C=N/NC(=O)c2cc3ccccc3o2)c1C,C02168765_decoy,WEE1,Decoy,0.0,-8.22252,-10.64,-1.07,-7.892105202486595
CC1CCN(S(=O)(=O)c2ccc(NC(=O)[C@H]3C4CCC(CC4)[C@@H]3C(=O)[O-])cc2)CC1,C17099034_decoy,WEE1,Decoy,0.0,-9.0476,-8.48,-2.31,-12.092402780452266
O=C([O-])[C@@H]1[C@H](C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)[C@@H]2C=C[C@H]1C2,C39679239_decoy,WEE1,Decoy,0.0,-8.93719,-8.86,-2.11,-8.45448078329891
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)[O-])cc2)c1,C13166758_decoy,WEE1,Decoy,0.0,-8.95199,-9.79,-0.94,-9.806360448542575
O=C(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)c1cc2cccc(F)c2o1,C41331920_decoy,WEE1,Decoy,0.0,-8.03281,-9.29,-1.79,-7.638317304726116
COc1ccc(N2C(=O)[C@@](NC(=O)c3ccc(F)cc3)(C(F)(F)F)N=C2[O-])cc1,C02399267_decoy,WEE1,Decoy,0.0,-6.83664,-8.77,-1.76,-9.27271310526093
CC1=C[C@@H]2C[C@H]1[C@H]1C(=O)N(c3ccc(C(=O)Nc4ccccc4C(=O)[O-])cc3)C(=O)[C@@H]12,C17903760_decoy,WEE1,Decoy,0.0,-7.69988,-9.02,-0.73,-6.951409845678089
O=S(=O)(/N=C1/CCCCCN1)c1cccc([N-]S(=O)(=O)c2cccs2)c1,C13041664_decoy,WEE1,Decoy,0.0,-9.08797,-5.16,-1.09,-5.400015741952613
C[C@H](NC(=O)c1ccc([N-]S(C)(=O)=O)cc1)c1cc2c(cc1Br)OCCO2,C59582784_decoy,WEE1,Decoy,0.0,-7.13969,-5.51,-0.6,-4.751738521406227
O=C(C[C@H]1SC([N-]N=C2CCCCCCCCCCC2)=NC1=O)NC[C@H]1CCCO1,C22505830_decoy,WEE1,Decoy,0.0,-8.48061,-8.19,-2.86,-7.078844254235001
Cc1nn(-c2ccc([O-])nn2)c2c1[C@H](c1ccc(F)c(Br)c1)CC(=O)N2,C31818108_decoy,WEE1,Decoy,0.0,-8.22218,-5.97,-0.74,-4.200730928317444
Cc1nn(-c2ccc([O-])nn2)c2c1[C@H](c1ccc(Br)cc1F)CC(=O)N2,C36358009_decoy,WEE1,Decoy,0.0,-7.48619,-5.08,0.1,-3.735674864670013
O=C(Cc1csc([N-]S(=O)(=O)c2ccccc2)n1)NC1=CC2=CC=N[C@H]2C=C1,C39978786_decoy,WEE1,Decoy,0.0,-9.83627,-8.79,-3.05,-9.600556934641304
C[C@@H](NC(=O)C1=NC=C(S(=O)(=O)[N-]c2ccccc2F)C1)c1cc2ccccc2o1,C64103707_decoy,WEE1,Decoy,0.0,-8.7825,-8.87,-1.6,-8.09392846494315
CC1=C(C(=O)Nc2cc(C)ccn2)[C@H](c2cnn(C)c2)C2=C([O-])C[C@@H](c3ccccc3)CC2=N1,C18096094_decoy,WEE1,Decoy,0.0,-7.60607,-5.59,-1.62,-5.259740038500205
Cc1ccc([N-]S(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C(=O)N2CCCC2)S3)cc1F,C65021468_decoy,WEE1,Decoy,0.0,-8.0974,-5.63,-3.45,-4.643449008899624
Cc1cc(C)cc([N-]S(=O)(=O)[C@H]2N=NC=C2C(=O)Nc2cccc(C(F)(F)F)c2)c1,C65055564_decoy,WEE1,Decoy,0.0,-7.64871,-9.37,-3.6,-8.155911823706822
O=C([O-])c1cc(NS(=O)(=O)c2cccs2)cc(NS(=O)(=O)c2cccs2)c1,C03884797_decoy,WEE1,Decoy,0.0,-9.62876,-4.78,-1.97,-5.762994436840383
O=C(N/N=C/c1cc(Cl)cc([N+](=O)[O-])c1[O-])c1ccccc1NS(=O)(=O)c1cccs1,C06131744_decoy,WEE1,Decoy,0.0,-7.34801,-8.55,-3.77,-7.013309087602852
Cc1ccc(C(=O)[O-])cc1NC(=S)NC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1,C09064673_decoy,WEE1,Decoy,0.0,-7.40198,-8.88,-1.9,-7.282190100839131
O=C([O-])c1ccccc1NS(=O)(=O)c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1,C09335516_decoy,WEE1,Decoy,0.0,-8.4088,-9.09,-2.28,-9.049833037499043
O=C([O-])c1cccc([C@H]2Nc3ccc(S(=O)(=O)Nc4ncccn4)cc3[C@H]3[C@H]4CC[C@H](C4)[C@@H]32)c1,C12428645_decoy,WEE1,Decoy,0.0,-9.47418,-8.82,-1.4,-8.838084638742847
O=C([O-])c1ccccc1NS(=O)(=O)c1cccc(NS(=O)(=O)c2cc(F)cc(F)c2)c1,C13027651_decoy,WEE1,Decoy,0.0,-7.83101,-8.16,-3.92,-8.663780388075777
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1,C13031502_decoy,WEE1,Decoy,0.0,-9.0204,-5.72,-1.59,-4.750349700885375
Cc1ccc(C(=O)Nc2cccc([C@H]3C=C(c4ccc(O[C@@H](C)C(=O)[O-])cc4)Nc4nnnn43)c2)cc1,C13077465_decoy,WEE1,Decoy,0.0,-8.89176,-10.07,-2.92,-8.406810166704918
Cc1cc(C)c(NC(=O)CNc2ccc(S(=O)(=O)N3CCCCC3)cc2C(=O)[O-])c(C)c1,C13192111_decoy,WEE1,Decoy,0.0,-8.66709,-9.41,-4.56,-7.655313258640866
C[C@@H]1[C@H](C)CCC[C@H]1NC(=O)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1CC(=O)[O-],C13204480_decoy,WEE1,Decoy,0.0,-8.13154,-8.81,-3.9,-6.877631384358157
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)NC(=O)NC34CC5CC(CC(C5)C3)C4)n2CC(=O)[O-])cc1,C13206056_decoy,WEE1,Decoy,0.0,-8.12069,-7.28,-2.48,-7.863382927359805
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)c1C,C13247793_decoy,WEE1,Decoy,0.0,-10.0934,-8.88,-2.39,-8.768739682184036
Cc1ccc(C)n1-c1ccc(C(=O)NNS(=O)(=O)c2cc(C(=O)[O-])c(Cl)cc2Cl)cc1,C13265022_decoy,WEE1,Decoy,0.0,-8.56945,-9.65,-1.72,-11.983787053264836
CC[C@H](C)NC(=O)NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1-c1ccc(F)cc1,C13265990_decoy,WEE1,Decoy,0.0,-8.45527,-9.02,-3.05,-9.769993491897464
O=C([O-])c1ccccc1NS(=O)(=O)c1ccc(N[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1,C13272581_decoy,WEE1,Decoy,0.0,-6.14904,-9.07,-1.44,-6.951826005866073
O=C([O-])c1ccccc1NS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc(F)c2)c1,C13340736_decoy,WEE1,Decoy,0.0,-7.51467,-9.57,-4.41,-7.85203422782832
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1,C13360579_decoy,WEE1,Decoy,0.0,-8.70269,-8.06,-2.19,-6.640638370649442
CC1=CC[C@@](C(=O)[O-])(C(=O)NNC=C2C(=O)OC(C)(C)OC2=O)[C@H](c2ccc(Br)cc2)C1,C15230737_decoy,WEE1,Decoy,0.0,-8.79438,-5.56,-2.17,-5.418307596412903
O=C(/C=C/c1cccc([N+](=O)[O-])c1)NC(=S)Nc1ccc(Br)cc1C(=O)[O-],C16399709_decoy,WEE1,Decoy,0.0,-7.8125,-8.66,-1.12,-7.907049610424035
Cn1c([O-])c2ccc(C(=O)NCCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2nc1=S,C09891529_decoy,WEE1,Decoy,0.0,-7.48946,-9.77,-1.62,-9.041383850393286
Cc1nc2cc(NC(=O)c3cc(=O)[nH]c4ccc(S(=O)(=O)[N-]c5ccc(F)cc5)cc34)ccc2o1,C22131567_decoy,WEE1,Decoy,0.0,-8.00242,-9.91,-3.35,-8.794808657000628
CCn1c([O-])c2ccc(C(=O)Nc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3)cc2nc1=S,C24787470_decoy,WEE1,Decoy,0.0,-8.82702,-10.83,-1.44,-12.749361942523793
COc1ccc(NC(=O)c2cc3ccccc3cc2[N-]S(=O)(=O)c2cccs2)cc1NC(C)=O,C25591915_decoy,WEE1,Decoy,0.0,-9.12458,-5.9,-4.67,-5.398790933715772
COc1c2c(c(C)c3c1C(=O)OC3)O[C@]1(C)C[C@@H](O)[C@@H](C(C)(C)O)[C@@](C)(CCC(=O)[O-])[C@@H]1C2,C31160807_decoy,WEE1,Decoy,0.0,-9.17378,-8.86,-4.2,-5.222856796813544
NC(=O)[C@@H]1CCCN(c2nc3ccccc3nc2[N-]S(=O)(=O)c2ccccc2C(F)(F)F)C1,C32871812_decoy,WEE1,Decoy,0.0,-7.44895,-5.76,-2.24,-5.1521314743052296
COc1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C([O-])C(=O)N2c2ccc(S(N)(=O)=O)cc2)cc1,C06023668_decoy,WEE1,Decoy,0.0,-9.32457,-6.14,-3.2,-5.55345711424215
COc1ccc(NC(=O)Nc2cc(C(=O)[O-])ccc2N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(OC)c1,C03047703_decoy,WEE1,Decoy,0.0,-9.76108,-8.5,-1.34,-9.780678138709227
COc1cccc(NC(=O)Nc2cc(C(=O)[O-])ccc2N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1,C03040696_decoy,WEE1,Decoy,0.0,-8.04767,-6.26,-2.98,-4.910946815167735
COc1ccc(/C=N/NC(=O)[C@]2(C)CC[C@@H](c3nc4ccccc4[nH]3)C2(C)C)c(C(=O)[O-])c1OC,C38547733_decoy,WEE1,Decoy,0.0,-8.23507,-7.46,-2.88,-6.33641327225307
COc1ccc(-c2nnc([S-])n2CC(=O)NNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1,C17444922_decoy,WEE1,Decoy,0.0,-9.05525,-9.45,-2.19,-7.559477047751567
Cc1cc(C(=O)[O-])cc(S(=O)(=O)/N=c2/[nH]c(-c3ccc4c(c3)NC(=O)CO4)cs2)c1C,C13031436_decoy,WEE1,Decoy,0.0,-6.22989,-7.68,-1.04,-5.078235879412926
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)/N=c1/[nH]c(-c2ccc3c(c2)NC(=O)CO3)cs1,C13031439_decoy,WEE1,Decoy,0.0,-8.6231,-5.97,-2.4,-6.116021775923179
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(S(=O)(=O)/N=c3/cccc[nH]3)cc2)c1C,C13036149_decoy,WEE1,Decoy,0.0,-7.58591,-7.52,-3.34,-6.445934734347174
Cc1ccc2c(c1)/C(=N/NC(=O)c1ccc([N-]S(=O)(=O)c3cccs3)cc1)C(O)=N2,C13598436_decoy,WEE1,Decoy,0.0,-8.62808,-10.24,-2.05,-8.949740963479892
C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4ccc(S(=O)(=O)N5CCC[C@H](C(=O)[O-])C5)cc4)cc3c2C1,C46330168_decoy,WEE1,Decoy,0.0,-10.1593,-7.16,-1.68,-6.280167506749359
O=C(Nc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)[O-])C2)cc1)c1ccc2[nH]c3c(c2c1)CCCC3,C13398041_decoy,WEE1,Decoy,0.0,-9.93679,-11.07,-1.87,-8.631019612358443
N#CC(=C\c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)/C([O-])=N/c1ccccc1[N+](=O)[O-],C13401014_decoy,WEE1,Decoy,0.0,-7.98867,-9.51,-0.73,-12.249912776313725
O=C(CC[C@@H](O)c1ccccc1)N/N=C/c1cc(I)c([O-])c([N+](=O)[O-])c1,C58886438_decoy,WEE1,Decoy,0.0,-8.10243,-8.79,-1.28,-7.945745626125412
O=C(CNc1ccc(I)cc1)N/N=C/c1cc(Cl)cc([N+](=O)[O-])c1[O-],C20478621_decoy,WEE1,Decoy,0.0,-8.05845,-8.15,-0.02,-7.380123886583789
O=C(Nc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)nn2)cc1,C59167678_decoy,WEE1,Decoy,0.0,-7.51227,-10.14,-3.5,-8.017112625292773
O=C([O-])/C=C/c1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)/N=C3/CCCCCN3)cc2)cc1,C13360585_decoy,WEE1,Decoy,0.0,-8.73726,-8.64,-2.63,-7.79824160172722
CC1CCN(c2ccc(C(=O)NC(=S)Nc3ccc(C(=O)[O-])cc3)cc2[N+](=O)[O-])CC1,C20153100_decoy,WEE1,Decoy,0.0,-7.97703,-8.43,-1.31,-7.391289349694478
O=C([O-])c1cc(NC(=S)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c(Cl)cc1Cl,C20153335_decoy,WEE1,Decoy,0.0,-8.96734,-8.45,-2.97,-9.574066168304302
COc1ccc(C(=O)[O-])cc1NC(=O)[C@H]1CC(O)=Nc2c(C)c(-c3ccc(Cl)cc3)nn21,C35684919_decoy,WEE1,Decoy,0.0,-9.38992,-9.05,-1.14,-8.595209076314045
CC(C)NC(=O)CN1CCN(c2ccc(NC(=O)c3cccc(Cl)c3)c(C(=O)[O-])c2)CC1,C35529918_decoy,WEE1,Decoy,0.0,-9.7739,-8.39,-1.33,-7.519390381603922
Cc1ccc(NC(=O)CN2CCN(c3ccc(NC(=O)C(C)C)c(C(=O)[O-])c3)CC2)cc1,C64589709_decoy,WEE1,Decoy,0.0,-8.76276,-9.23,-3.74,-8.442186518272703
CC(=O)Nc1c(C)cc(C)cc1-c1nnc(SCC(=O)Nc2cc(C)cc(C)c2)nc1[O-],C64774488_decoy,WEE1,Decoy,0.0,-9.09928,-9.9,-2.76,-8.529197040121804
CC(=O)Nc1c(C)cc(C)cc1-c1nnc(SCC(=O)Nc2ccc(C(C)C)cc2)nc1[O-],C64774493_decoy,WEE1,Decoy,0.0,-9.05751,-8.57,-3.9,-8.069896802065296
CC(=O)Nc1c(C)cc(C)cc1-c1nnc(S[C@H](C)C(=O)Nc2ccc(F)cc2C)nc1[O-],C64774523_decoy,WEE1,Decoy,0.0,-9.13957,-8.79,-3.02,-7.827559711502352
O=C(Nc1ccccc1[N-]S(=O)(=O)c1cccs1)c1cccc(NC(=O)[C@@H]2CCCO2)c1,C36831635_decoy,WEE1,Decoy,0.0,-9.98203,-9.81,-2.03,-9.23093320581764
O=C(NC(=S)Nc1ccc(Br)cc1F)c1ccc(-c2cccc([N+](=O)[O-])c2)o1,C02880205_decoy,WEE1,Decoy,0.0,-7.49598,-9.9,0.19,-9.65225673578484
COC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(N)=C(C#N)[C@H]1c1ccc(Cl)cc1,C00659974_decoy,WEE1,Decoy,0.0,-9.04629,-8.05,-1.83,-7.870536337937668
COc1ccc([C@@H]2Nn3c(C)nnc3S[C@H]2C(=O)Nc2ccc(Br)c(C)c2)cc1,C09236853_decoy,WEE1,Decoy,0.0,-9.9235,-4.93,-1.42,-4.89462544888221
COc1ccc([C@H]2Nn3c(C)nnc3S[C@@H]2C(=O)Nc2ccccc2C)cc1Br,C09237766_decoy,WEE1,Decoy,0.0,-9.29686,-5.03,-3.03,-6.780710985656124
COc1ccc([C@H]2Nn3c(C)nnc3S[C@H]2C(=O)Nc2ccccc2C)cc1Br,C09237767_decoy,WEE1,Decoy,0.0,-8.89278,-6.09,-1.32,-4.884496148525287
COc1ccc([C@H]2Nn3c(C)nnc3S[C@@H]2C(=O)Nc2cccc(C)c2)cc1Br,C09237795_decoy,WEE1,Decoy,0.0,-8.10698,-6.87,-1.89,-6.829850065075793
O=C(COC(=O)c1c2c(nc3ccccc13)CCC2)NNC(=O)c1ccc(Br)cc1,C03341412_decoy,WEE1,Decoy,0.0,-8.52996,-9.13,-3.16,-8.307380528706265
CCc1ccccc1NC(=O)C(=O)Nc1ccc2c(c1)N(S(=O)(=O)c1cccs1)CCC2,C09739843_decoy,WEE1,Decoy,0.0,-9.3464,-8.28,-3.12,-8.225081880160785
O=C(Cc1csc(NC(=O)c2ccc3c(c2)OCO3)n1)Nc1ccc(Br)cc1F,C09813896_decoy,WEE1,Decoy,0.0,-9.79657,-8.61,-0.72,-8.282649335386418
CCC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CN3C(=O)NC4(CCC(C)CC4)C3=O)c2C#N)C1,C12617025_decoy,WEE1,Decoy,0.0,-9.39567,-8.38,-1.96,-7.624757689369035
Cc1ccc(-c2ccsc2C(=O)Nc2ccc(S(=O)(=O)/N=c3\o[nH]c(C)c3C)cc2)cc1,C14169247_decoy,WEE1,Decoy,0.0,-9.08094,-7.98,-2.08,-7.486780349258346
CC(=O)Nc1cccc(NC(=O)c2cccc(S(=O)(=O)N3C[C@@]4(C)C[C@@H]3CC(C)(C)C4)c2)c1,C15421790_decoy,WEE1,Decoy,0.0,-9.09687,-10.35,-5.23,-8.987886560800622
Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCCCN3)cc2)c(C)c1C,C16098466_decoy,WEE1,Decoy,0.0,-7.94139,-7.79,-3.89,-6.516168431675434
N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc(Br)c2)[C@H]2CN(C(=O)OCc3ccccc3)CC=C12,C08441958_decoy,WEE1,Decoy,0.0,-9.9945,-6.18,-0.72,-5.867275379606864
Cc1cc(C(=O)Nc2ccccc2C(=O)NC2CC2)cc(S(=O)(=O)N2CCC(C)CC2)c1C,C20010093_decoy,WEE1,Decoy,0.0,-9.10612,-9.84,-1.85,-11.616527756137874
COc1ccc(NC(=O)[C@H]2[C@@H]3NC(=S)N(c4ccccc4)[C@@]2(C)Oc2c(OC)cccc23)cc1,C20641381_decoy,WEE1,Decoy,0.0,-7.56189,-6.31,-2.6,-5.171407144436072
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1,C21352022_decoy,WEE1,Decoy,0.0,-8.2328,-8.46,-2.83,-7.29067230734695
Cc1ccc(N2C[C@H](C(=O)Nc3ccc(S(=O)(=O)NC4CCCCC4)cc3)CC2=O)cc1C,C21450717_decoy,WEE1,Decoy,0.0,-8.04958,-8.65,-3.28,-6.186930927382101
CC(C)(C)C(=O)NC(=S)Nc1ccc(N2CCN(C(=O)c3cc4ccccc4o3)CC2)cc1,C21577015_decoy,WEE1,Decoy,0.0,-8.90739,-8.85,-3.18,-7.027595484932701
O=C(NC[C@@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2F)CC1)NC1CCCCC1,C22851568_decoy,WEE1,Decoy,0.0,-8.82527,-8.79,-2.48,-7.484040128756108
O=C(Nc1cccc(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1)c1cccs1,C24033259_decoy,WEE1,Decoy,0.0,-8.32337,-5.79,-3.29,-5.587337578302986
Cc1c(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)sc2nc3n(c(=O)c12)CCCCC3,C27299634_decoy,WEE1,Decoy,0.0,-9.99857,-8.65,-2.61,-11.346069328583736
Cc1ccc(C(=O)C2=C(N)N(c3ccccc3)C3=C(C(=O)CCC3)[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1,C27531048_decoy,WEE1,Decoy,0.0,-5.83995,-5.94,-2.74,-4.441197966288754
Cc1ccc(C(=O)C2=C(N)N(c3ccccc3)C3=C(C(=O)CCC3)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1,C27531053_decoy,WEE1,Decoy,0.0,-5.29837,-5.43,-2.07,-3.022749790514079
CC(C)c1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCCO4)cc2)cc1,C27637487_decoy,WEE1,Decoy,0.0,-9.33429,-5.23,-1.09,-5.777336556693661
Cc1ccc(-c2nn3c(C)nnc3s2)cc1NC(=S)NC(=O)c1ccc(C(C)(C)C)cc1,C32127725_decoy,WEE1,Decoy,0.0,-9.72496,-9.21,-1.55,-8.83927594421691
COc1ccc(NC(=O)N2CCC(NS(=O)(=O)c3ccc(Br)cc3)CC2)cc1,C33122631_decoy,WEE1,Decoy,0.0,-7.64091,-9.42,-4.01,-7.537700881889396
Cc1ccc(NC(=O)N2CCC([C@H](NC(=O)c3cccs3)C(=O)N3CCCCC3)CC2)cc1,C36213837_decoy,WEE1,Decoy,0.0,-8.97815,-7.08,-3.8,-7.113247215776145
C=CCN1C(=O)[C@H]2[C@@H](C(=O)N[C@@H]3CCCC[C@H]3C)[C@]3(C)C=C[C@]2(O3)[C@H]1C(=O)NC1CCCCC1,C33939959_decoy,WEE1,Decoy,0.0,-8.7019,-8.61,-2.14,-9.105267654275812
Cc1ccc2sc(NNC(=O)c3ccc(S(=O)(=O)N4C[C@H](C)C[C@H](C)C4)cc3)nc2c1C,C17122330_decoy,WEE1,Decoy,0.0,-10.2347,-10.08,-0.9,-8.86666822007554
Cc1cc(C)c2nc(NNC(=O)c3ccc(S(=O)(=O)N4C[C@H](C)C[C@@H](C)C4)cc3)sc2c1,C08683797_decoy,WEE1,Decoy,0.0,-9.6974,-10.62,-1.74,-8.462068879971634
O=C(NC[C@H](c1cccs1)S(=O)(=O)c1ccc(Cl)cc1)Nc1ccc2c(c1)OCO2,C38563337_decoy,WEE1,Decoy,0.0,-8.70178,-5.72,-3.29,-5.832058052411696
O=C(NC[C@@H](c1cccs1)S(=O)(=O)c1ccc(Cl)cc1)Nc1ccc2c(c1)OCO2,C38563338_decoy,WEE1,Decoy,0.0,-8.89217,-6.63,-3.0,-7.302205966714725
COc1cccc([C@@H]2C(C#N)=C(N)O[C@@H]3N=NC(C)=C23)c1OCc1ccc(Br)cc1,C38610792_decoy,WEE1,Decoy,0.0,-7.2946,-5.56,-2.98,-5.39371350598558
CC(C)c1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H]4COc5ccccc5O4)ccc32)cc1,C38687056_decoy,WEE1,Decoy,0.0,-9.68101,-10.42,-1.25,-13.350086201373331
COc1cc([C@@H]2C(C#N)=C(N)O[C@@H]3N=NC(C)=C23)cc(Br)c1OCc1cccc(C)c1,C39243237_decoy,WEE1,Decoy,0.0,-8.37159,-9.46,-0.85,-9.292185403477166
COc1cc([C@H]2C(C#N)=C(N)OC3=NN=C(c4ccccc4)[C@@H]32)ccc1OCc1ccc(F)cc1,C08566412_decoy,WEE1,Decoy,0.0,-8.92155,-8.11,-1.83,-9.107648075137853
COc1ccc([C@H]2C(C#N)=C(N)O[C@@H]3N=NC(C)=C23)cc1COc1ccccc1Br,C39273147_decoy,WEE1,Decoy,0.0,-8.38758,-5.57,-2.7,-4.605021148450865
COC(=O)c1ccc([C@H]2C3=C(CC(C)(C)CC3=O)Nc3nc(SCC(C)C)[nH]c(=O)c32)cc1,C40476489_decoy,WEE1,Decoy,0.0,-9.01578,-5.72,-3.6,-5.852333751255245
COC(=O)c1c(NC(=O)N/N=C\c2ccc(OC)c(Br)c2)sc2c1CCCC2,C40844483_decoy,WEE1,Decoy,0.0,-8.94708,-8.26,-2.47,-8.546098698617376
C[C@H](NC(=O)c1ccccc1NC(=O)C1CCN(c2ccc(Cl)nn2)CC1)c1ccccc1,C46570297_decoy,WEE1,Decoy,0.0,-8.39408,-6.06,-2.48,-5.430061759410624
CCOC(=O)C1=CN(C2CC2)c2cc(N3CCC4=C(C3)/C(=N\OC)[C@@H](C)CS4)c(N)cc2C1,C49035037_decoy,WEE1,Decoy,0.0,-7.58426,-8.02,-1.97,-6.53866304235675
O=C(Nc1ccc2c(c1)OCO2)c1nn2c(c1Cl)N[C@@H](c1ccc(F)cc1)C[C@H]2C(F)(F)F,C02475887_decoy,WEE1,Decoy,0.0,-8.12103,-7.83,-0.97,-6.6380613311895145
COc1ccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](c2ccc(F)cc2)N3)c(OC)c1,C00673749_decoy,WEE1,Decoy,0.0,-8.08838,-9.4,-1.55,-7.56176552756755
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N[C@@H](C)c3ccc4c(c3)OCCO4)cc2)cc1C,C18110115_decoy,WEE1,Decoy,0.0,-8.81322,-9.52,-2.94,-7.122364073329185
O=C(Nc1cccc(Cl)c1)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@@H](c1ccc3c(c1)OCO3)N2,C00793190_decoy,WEE1,Decoy,0.0,-7.90298,-6.37,-4.85,-4.659003804270498
O=C(Nc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1)c1cccs1,C24028573_decoy,WEE1,Decoy,0.0,-9.78733,-5.75,-1.48,-5.771466767985016
COc1ccc([C@@H]2C(C#N)=C(N)OC3=NN=C(c4ccccc4)[C@@H]32)c(CSc2ccccn2)c1,C01089453_decoy,WEE1,Decoy,0.0,-7.22335,-4.64,-1.93,-4.959444628184127
O=C(Nc1nc2ccc(NC(=O)[C@@H]3N=NC4=C3CCc3ccccc34)cc2s1)c1ccccc1,C63600767_decoy,WEE1,Decoy,0.0,-8.82684,-10.21,-1.47,-7.539300772962242
Nc1c(-c2nc(-c3ccc4c(c3)OCO4)cs2)nnn1-c1cc(C(F)(F)F)ccc1Cl,C64948721_decoy,WEE1,Decoy,0.0,-9.43179,-8.9,-1.06,-6.712379707155884
C[C@@H]1[C@H](C)CCC[C@@H]1NC(=O)[C@H]1N(C2CC2)C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(Cl)cc3)[C@H]3C=C[C@]21O3,C04127928_decoy,WEE1,Decoy,0.0,-8.68091,-5.74,-2.38,-5.854988292859135
CCOC(=O)c1c(N2C(N)=C(C#N)[C@@H](c3cccnc3)C3=C2CCCC3=O)sc2c1CCCCC2,C00714781_decoy,WEE1,Decoy,0.0,-8.84015,-4.88,-2.26,-4.952167032462745
CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=C/C(=N\OCC(=O)N[C@H]5CCCCNC5=O)CC[C@@]4(C)[C@@H]3CC[C@@]21C,C08817835_decoy,WEE1,Decoy,0.0,-9.08511,-6.87,-5.27,-5.9703116822390925
Cc1cc(Cl)ccc1NC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)CC1,C09265888_decoy,WEE1,Decoy,0.0,-9.5507,-10.04,-3.57,-7.610807076961159
Cc1ccc(NC(=O)CNC(=O)Cn2cnc3sc4c(c3c2=O)CCCC4)c(Br)c1,C02924714_decoy,WEE1,Decoy,0.0,-9.2965,-9.38,-1.45,-8.155452814187017
CC(=O)Nc1ccc(NC(=O)c2cc(Br)cc(S(=O)(=O)N3CCC(C)CC3)c2)cc1,C09662710_decoy,WEE1,Decoy,0.0,-9.80013,-5.9,-0.48,-5.96035225492514
CC[C@@H]1CCc2sc(-c3nnc(SCC(=O)NNC(=O)c4ccc(Cl)cc4)n3C)cc2C1,C10440178_decoy,WEE1,Decoy,0.0,-10.7405,-9.02,-1.73,-8.039117150025554
O=C(Nc1ccccc1Cc1ccccc1)c1cccc(S(=O)(=O)N[C@H]2CCS(=O)(=O)C2)c1,C12228924_decoy,WEE1,Decoy,0.0,-9.11298,-9.79,-1.8,-8.754407743727908
O=C(NC1CC1)c1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccccc3C(F)(F)F)CC2)c1,C12688722_decoy,WEE1,Decoy,0.0,-8.78203,-9.3,-2.92,-9.093660658225478
CC(C)(C)c1ccc(NC(=O)c2ccc(NC(=O)C[C@H]3SC(N4CCCCC4)=NC3=O)cc2)cc1,C12781442_decoy,WEE1,Decoy,0.0,-9.25736,-10.01,-1.44,-16.127350693450698
O=C(NCC1CCCCC1)C1CCN(C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)CC1,C13352918_decoy,WEE1,Decoy,0.0,-10.0757,-9.67,-3.79,-10.74327902141764
Cc1sc2nc(CSc3ccc(Cl)cc3)nc(N3CCN(S(N)(=O)=O)CC3)c2c1C,C14248819_decoy,WEE1,Decoy,0.0,-11.1913,-8.73,-1.57,-10.505546701924755
Cc1cccc(O[C@H](C)C(=O)NNC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1C,C14368213_decoy,WEE1,Decoy,0.0,-7.00856,-9.65,-3.34,-8.139983451968206
C=CCN(C)C(=O)[C@@H](C)[C@H]1CC[C@@]2(C)Cc3sc(NC(=O)c4cccn4C)nc3[C@@H](C)[C@@H]2[C@H]1O,C15709097_decoy,WEE1,Decoy,0.0,-8.6159,-7.49,-3.0,-11.18004289325042
Cc1cc(NC(=O)CN(C)S(=O)(=O)c2ccc3c(c2)NC(=O)CCS3)ccc1Br,C15728475_decoy,WEE1,Decoy,0.0,-9.71327,-8.28,-2.13,-8.028403521891544
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(Br)cc3)cc2)C1,C16044748_decoy,WEE1,Decoy,0.0,-7.59244,-10.23,-2.69,-7.922385361924611
COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2Br)c1,C16094811_decoy,WEE1,Decoy,0.0,-9.23411,-7.87,-2.82,-6.406399101070104
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)/C=C/c1cc(Br)ccc1F,C16116479_decoy,WEE1,Decoy,0.0,-8.91916,-9.11,-3.51,-8.241833368164672
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cccc(C(=O)NCC(=O)Nc3ccc(F)c(F)c3F)c2)C1,C18049604_decoy,WEE1,Decoy,0.0,-9.06493,-9.32,-1.73,-10.54495213583872
Cc1cc(N2CCCC2)ccc1NC(=O)COC(=O)c1cc(-c2ccc(Br)cc2)n[nH]1,C19353459_decoy,WEE1,Decoy,0.0,-9.45513,-9.73,-0.64,-10.321866424618952
CC(=O)Nc1ccc(N2C[C@@H](C(=O)Nc3ccc(-c4nc5ccc(C)cc5s4)cc3)CC2=O)cc1,C20371071_decoy,WEE1,Decoy,0.0,-9.0428,-5.59,-2.62,-5.161161523563543
COC(=O)c1c(NC(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)sc2c1CCCC2,C20571345_decoy,WEE1,Decoy,0.0,-10.5085,-10.0,-1.4,-9.74814067884516
CC(C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)cc2)C1,C21706563_decoy,WEE1,Decoy,0.0,-9.45105,-11.04,-2.77,-9.399037434466518
CC(C)(C)c1ccc(S(=O)(=O)Nc2cccc(C(=O)N3CCC[C@@H](C(=O)NC4CC4)C3)c2)cc1,C21710629_decoy,WEE1,Decoy,0.0,-9.76663,-10.13,-3.56,-9.35490689804682
O=C(NC1CC1)c1ccc(NC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)cc1,C22193025_decoy,WEE1,Decoy,0.0,-8.78137,-9.94,-2.76,-10.389883235351585
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)Nc3nc(-c4c[nH]c5ccccc45)cs3)C2)s1,C22691453_decoy,WEE1,Decoy,0.0,-9.23812,-9.05,-3.42,-7.437440842869594
O=C(CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)NNC(=O)c1ccccc1F,C23647016_decoy,WEE1,Decoy,0.0,-8.5909,-9.69,-5.43,-8.789391737842276
CC1CCN(S(=O)(=O)c2ccc(C(=O)Nc3cccc(NC(=O)c4cccs4)c3)cc2)CC1,C24033350_decoy,WEE1,Decoy,0.0,-9.11701,-9.95,-1.63,-8.424432927274633
CNS(=O)(=O)c1cc(C(=O)Nc2cccc(C(=O)N3CCc4sccc4C3)c2C)cc(C)c1C,C26053292_decoy,WEE1,Decoy,0.0,-8.76357,-9.26,-1.32,-7.901832745816375
CC(C)(C)OC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(Br)ccc3F)[C@@H]2C1,C09113433_decoy,WEE1,Decoy,0.0,-9.30027,-4.75,-0.91,-5.055486395560879
CSc1sc(C)cc1[C@@H]1C(C#N)=C(N)N(c2cc([N+](=O)[O-])ccc2Cl)C2=C1C(=O)CCC2,C27550467_decoy,WEE1,Decoy,0.0,-10.4791,-5.14,-1.52,-4.897675968568536
Cc1cc([C@@H]2C(C#N)=C(N)N(c3cc([N+](=O)[O-])ccc3Cl)C3=C2C(=O)CC(C)(C)C3)c(C)s1,C27550481_decoy,WEE1,Decoy,0.0,-8.70361,-5.2,-4.15,-5.362029484505826
COc1c(Br)cc(Br)cc1C(=O)Nc1nc2ccc(NC(C)=O)cc2o1,C32126203_decoy,WEE1,Decoy,0.0,-8.24802,-8.32,-1.43,-8.752705676571322
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)N[C@@H](C)c3ccc4c(c3)OCCCO4)c2)cc1F,C32284616_decoy,WEE1,Decoy,0.0,-9.09597,-5.19,-2.59,-5.539089760801859
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)N[C@@H](C)c3ccc4c(c3)OCCCO4)cc2)ccc1F,C32284734_decoy,WEE1,Decoy,0.0,-9.32784,-5.84,-4.46,-5.318368128439802
Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)Nc3cc(C(F)(F)F)c[nH]c3=O)CC2)c1C,C32876268_decoy,WEE1,Decoy,0.0,-7.02319,-8.55,-1.37,-5.726526458758852
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NCCc3cc(F)cc4c3OCOC4)cc2)ccc1F,C32921852_decoy,WEE1,Decoy,0.0,-8.86929,-6.19,-1.76,-5.811423567927561
O=C(c1ccc([C@H]2Nc3ccccc3S(=O)(=O)N2)cc1)N1CCN(c2ccc(Cl)cc2)CC1,C33063269_decoy,WEE1,Decoy,0.0,-8.9662,-7.12,-1.99,-6.198087476058253
O=C(Nc1ccc(F)cc1)c1nnc([C@H]2CCCN(C(=O)Nc3ccccc3C(F)(F)F)C2)s1,C33113028_decoy,WEE1,Decoy,0.0,-8.697,-9.31,-1.57,-8.072797485414382
O=C(N[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1CCCN1S(=O)(=O)Cc1ccccc1)c1ccc(F)cc1,C34900368_decoy,WEE1,Decoy,0.0,-8.92012,-7.81,-2.08,-7.415618421194023
Cc1ccc(C(=O)Nc2ccc([C@H]3OC(=O)N(Cc4cccc(C)c4)[C@@H]3C(=O)NC(C)C)cc2)cc1,C35752828_decoy,WEE1,Decoy,0.0,-9.17873,-9.1,-5.07,-7.54802237775724
CC(C)CCN1C(=O)[C@H]2[C@@H](C(=O)NC3CCCCC3)[C@@]3(C)C=C[C@@]2(O3)[C@@H]1C(=O)NC1CCCCC1,C33939840_decoy,WEE1,Decoy,0.0,-9.15595,-7.4,-2.64,-10.458564947903312
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC[C@@H]3C)cc2)sc2c1CC[C@@H](C)C2,C37593614_decoy,WEE1,Decoy,0.0,-10.2722,-5.96,-1.93,-5.417707368380556
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2)cc1,C45829534_decoy,WEE1,Decoy,0.0,-9.06708,-10.34,-1.32,-10.481380056395937
CNC(=O)c1ccc(C)c(NC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c1,C46706313_decoy,WEE1,Decoy,0.0,-8.55333,-10.81,-3.44,-8.26994742605241
O=C(Nc1ccccc1)c1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1,C46790102_decoy,WEE1,Decoy,0.0,-9.12133,-10.43,-3.07,-10.016310166640446
CCc1nnc2sc(-c3cccc(NC(=S)NC(=O)c4cccc(Br)c4)c3)nn12,C57316268_decoy,WEE1,Decoy,0.0,-9.93722,-9.01,-0.49,-9.328612406145789
COC(=O)c1c(NC(=O)CSc2nc(-c3ccc(Br)cc3)n[nH]2)sc2c1CCC2,C21157939_decoy,WEE1,Decoy,0.0,-10.2515,-8.1,-3.42,-8.065097784603818
O=C(CSc1nnc(-c2ccccc2Br)n1-c1ccccc1)NNC(=O)C1CCC1,C59844913_decoy,WEE1,Decoy,0.0,-8.33275,-7.55,-1.89,-9.983547709518144
O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1,C14111086_decoy,WEE1,Decoy,0.0,-8.73272,-10.25,-2.42,-9.070911963762551
COc1ccc(C(=O)N[C@H](Nc2cccc[nH+]2)C(Cl)(Cl)Cl)cc1OC,C04833256_decoy,WEE1,Decoy,0.0,-8.99622,-7.43,-3.1,-8.417655510248442
Cc1ccc(NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)[NH+](C)C)c(C)c1,C09135450_decoy,WEE1,Decoy,0.0,-7.86054,-9.4,-2.52,-7.524271294258807
Cc1ccc(C)c(NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)[NH+](C)C)c1,C09135454_decoy,WEE1,Decoy,0.0,-8.47082,-9.57,-3.19,-8.38500037190207
C[C@@H](C(=O)Nc1cc(F)ccc1F)[NH+]1CCC(NS(=O)(=O)c2cccs2)CC1,C11719796_decoy,WEE1,Decoy,0.0,-8.80879,-8.36,-3.0,-8.382162326988194
C[C@H](C(=O)Nc1ccc(F)c(F)c1)[NH+]1CCC(NS(=O)(=O)c2cccs2)CC1,C11719848_decoy,WEE1,Decoy,0.0,-9.66438,-6.9,-1.89,-8.821696548772278
COc1ccc(C[NH+]2CCNC(=O)[C@H]2CC(=O)NCc2ccc(C)s2)cc1C,C11813971_decoy,WEE1,Decoy,0.0,-7.74379,-8.02,-3.21,-7.206906790993194
CCOc1ccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@@H](O)c2ccc(OC)cc2O3)cc1,C12329549_decoy,WEE1,Decoy,0.0,-9.69827,-6.72,-1.99,-7.949296696794541
CCOc1ccc([C@@H](O)C[NH+]2CCC3(CC2)C[C@H](O)c2ccc(OC)cc2O3)cc1,C12329554_decoy,WEE1,Decoy,0.0,-9.6425,-6.46,-2.16,-6.995629991030173
COc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3[NH2+]Cc2ccc(O)c(OC)c2)cc1,C14975935_decoy,WEE1,Decoy,0.0,-8.93432,-8.07,-1.66,-7.050592447262049
O[C@H]1[C@H]([NH2+]Cc2ccc(OC(F)(F)F)cc2)[C@H]2CO[C@H](O2)[C@@H]1Oc1ccccc1,C20463712_decoy,WEE1,Decoy,0.0,-6.12104,-7.11,-2.36,-5.293584545866245
CC(=O)c1ccc(NC(=O)c2cnn(-c3cccc(C)c3)c2C2CC[NH2+]CC2)cc1,C20940932_decoy,WEE1,Decoy,0.0,-8.25632,-5.29,-0.89,-5.13750238728422
NC(=O)[C@H]1Cc2ccccc2C[NH+]1Cc1nc(-c2cccc(C(F)(F)F)c2)no1,C23078218_decoy,WEE1,Decoy,0.0,-7.0231,-8.82,-1.29,-10.004395509553795
O=C(C[NH+]1CCN(Cc2ccc(C(F)(F)F)cc2)CC1)NC(=O)NC1CCCC1,C23377508_decoy,WEE1,Decoy,0.0,-7.35581,-7.04,-2.0,-5.975449219976851
CC(C)(C)C1CCC(C(=O)Nc2cccc(S(=O)(=O)NC3=[NH+]CCC3)c2)CC1,C12975262_decoy,WEE1,Decoy,0.0,-9.47947,-9.79,-2.48,-14.897362824590374
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NCc1ccc[nH+]c1N(C)C,C32687694_decoy,WEE1,Decoy,0.0,-8.53162,-7.97,-1.98,-9.255820496386889
Cc1cc[nH+]c(N[C@@H](c2cccnc2)c2cc(C)sc2NC(=O)c2ccco2)c1,C38546994_decoy,WEE1,Decoy,0.0,-9.56057,-9.12,-2.12,-9.311710613441528
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)C1=NN[C@@H](c2ccc(Br)s2)C1,C38906479_decoy,WEE1,Decoy,0.0,-9.35965,-8.54,-3.9,-7.789274121284117
COC(=O)[C@@H]1CC2=C3CC=CC=C3N=C2[C@H]2C[C@@H]([NH2+]CCO)C[C@@H](c3ccc(F)cc3)N21,C39560819_decoy,WEE1,Decoy,0.0,-8.82532,-4.36,-1.91,-5.540514193189848
Cc1ccc(C(=O)N2C[C@H](C(=O)NC[C@@H](C)Oc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)cc1,C39595348_decoy,WEE1,Decoy,0.0,-8.28091,-8.7,-2.14,-8.005327683387948
COc1ccccc1CNC(=O)[C@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2,C39597281_decoy,WEE1,Decoy,0.0,-7.81721,-6.42,-2.81,-4.797498003789692
CCCCNC(=O)[C@@H]1CN(C(=O)c2cc(Cl)c(OC)c(Cl)c2)CC12CC[NH2+]CC2,C39624103_decoy,WEE1,Decoy,0.0,-9.60349,-7.08,-1.67,-9.391818751060292
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)NC3CCCC3)C3(CC[NH2+]CC3)C2)cc1Cl,C39632622_decoy,WEE1,Decoy,0.0,-9.18996,-7.58,-3.03,-9.158343675728268
COc1c(C(=O)N2C[C@@H](C(=O)NC3CCCCCC3)C3(CC[NH2+]CC3)C2)csc1Cl,C39633672_decoy,WEE1,Decoy,0.0,-9.62556,-7.14,-1.0,-8.23810139075206
COc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)cc1,C39635120_decoy,WEE1,Decoy,0.0,-7.1198,-8.8,-3.09,-7.716028796808416
COc1ccccc1CCNC(=O)[C@@H]1CN(C(=O)c2ccc(C)cc2C)CC12CC[NH2+]CC2,C39636402_decoy,WEE1,Decoy,0.0,-8.6842,-9.34,-2.43,-9.319180114761918
N#C[C@H](NC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CC12CC[NH2+]CC2)c1ccccc1,C39662189_decoy,WEE1,Decoy,0.0,-9.25425,-5.58,-2.38,-5.742264819574675
Cc1ccsc1C(=O)N1C[C@H](C(=O)NC[C@@H](C)Oc2ccccc2)C2(CC[NH2+]CC2)C1,C39665446_decoy,WEE1,Decoy,0.0,-7.10678,-9.34,-2.01,-8.476745245581235
CC[C@H](C)C(=O)N1C[C@H](C(=O)NCc2ccccc2N2CCCCC2)C2(CC[NH2+]CC2)C1,C39678269_decoy,WEE1,Decoy,0.0,-9.07098,-9.38,-3.76,-8.979186262675935
C[C@H](NC(=O)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccccc2)CC12CC[NH2+]CC2)C(C)(C)C,C39684462_decoy,WEE1,Decoy,0.0,-7.45351,-5.35,-1.46,-4.440954366796565
COc1ccccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C39686701_decoy,WEE1,Decoy,0.0,-8.74273,-9.63,-4.02,-8.83746735005601
C=C(C)CNC(=O)[C@@H]1CN(C(=O)[C@H](Oc2ccccc2)C(C)C)CC12CC[NH2+]CC2,C39691017_decoy,WEE1,Decoy,0.0,-8.41071,-9.34,-2.43,-10.249961170589694
CC[C@@H](NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1ccc(C)cc1,C39947287_decoy,WEE1,Decoy,0.0,-7.13238,-9.39,-2.64,-7.628943786864629
COc1ccc(NC(=O)NC[C@H]2C[C@H]3CC[NH+]2C[C@@H]3CN2CCSCC2)cc1,C43528178_decoy,WEE1,Decoy,0.0,-8.63319,-8.36,-1.38,-8.063152527778517
CNc1[nH+]c2c(s1)C[C@@]1(C)CC[C@H]([C@H](C)C(=O)N3CCOCC3)[C@@H](O)[C@H]1[C@@H]2C,C43548324_decoy,WEE1,Decoy,0.0,-8.11894,-7.86,-3.6,-6.503303524963712
CC(C)NC(=O)N1CCC(C(=O)NCc2ccc(C[NH+]3CCCC[C@H]3C)cc2)CC1,C46839050_decoy,WEE1,Decoy,0.0,-8.44947,-8.55,-3.09,-7.916979017285473
O=C(CN1CCC[NH+](CC(=O)Nc2ccc(F)cc2)CC1)Nc1ccc(F)cc1,C22036805_decoy,WEE1,Decoy,0.0,-7.86404,-6.29,-2.89,-5.6084544187071526
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1,C48101004_decoy,WEE1,Decoy,0.0,-8.34927,-9.06,-1.56,-13.559543035128687
O=C(NC[C@@H]1CCCO1)C1=CC2=[NH+][C@H](c3ccc(F)cc3)C[C@@H](C(F)(F)F)N2N1,C13124155_decoy,WEE1,Decoy,0.0,-7.09889,-8.9,-1.97,-8.235639611955014
O=C(NC[C@@H]1CCCO1)C1=CC2=[NH+][C@@H](c3ccc(F)cc3)C[C@@H](C(F)(F)F)N2N1,C13124156_decoy,WEE1,Decoy,0.0,-7.33203,-5.27,-1.98,-4.263491389806313
O=C(NCCC1=c2ccccc2=[NH+]C1)/C(=C/c1cccnc1)NC(=O)c1ccccc1,C63416399_decoy,WEE1,Decoy,0.0,-7.82987,-9.56,-3.6,-8.505221614701565
O=C(NCC[C@H]1C=c2ccccc2=[NH+]1)/C(=C/c1cccnc1)NC(=O)c1ccccc1,C63514519_decoy,WEE1,Decoy,0.0,-7.5407,-9.35,-3.14,-8.031484521269785
O=C(NCCC1=c2ccccc2=[NH+]C1)/C(=C\c1cccnc1)NC(=O)c1cccs1,C63581953_decoy,WEE1,Decoy,0.0,-7.26026,-9.18,-1.8,-7.901194968063707
Cc1cc(C)cc(N/C(=N\C(=O)c2cccnc2)NCCC2=c3ccccc3=[NH+]C2)c1,C63588612_decoy,WEE1,Decoy,0.0,-8.41997,-9.67,-1.45,-9.519800024438828
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1CCCN([C@@H]2Nc3cccnc3S2)C1,C63655786_decoy,WEE1,Decoy,0.0,-9.11985,-5.75,-2.3,-6.194564255275394
CC1=C(S(=O)(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)c2cccs2)[C@@H](C)N(C)N1,C63835578_decoy,WEE1,Decoy,0.0,-9.2764,-9.17,-1.13,-10.815316581512842
COc1ccc2c(c1)S[C@H](N1CC(C(=O)NCCC3=c4ccccc4=[NH+]C3)C1)N2,C64426946_decoy,WEE1,Decoy,0.0,-8.69961,-8.09,-3.27,-6.777548769180444
Cc1ccc2c(c1)=C(NC(=O)c1ccc(F)cc1)[C@@H](C(=O)NCc1ccc(C)o1)[NH+]=2,C64677129_decoy,WEE1,Decoy,0.0,-8.17195,-6.39,-1.15,-6.081634902585765
C=CCNC(=O)[C@H](C)S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccccc1C,C39756648_decoy,WEE1,Decoy,0.0,-9.05239,-7.42,-2.49,-6.903126912256319
Cc1cccc(CNC2=[NH+]CCNC23CCN(S(=O)(=O)c2ccccc2)CC3)c1,C65074689_decoy,WEE1,Decoy,0.0,-7.78105,-6.67,-3.92,-5.231818615589391
COc1ccc(C(=O)N2CC[C@@]3(C2)NCc2ccccc2N/C3=[NH+]\C2CCCC2)cc1,C65265874_decoy,WEE1,Decoy,0.0,-8.20488,-5.41,-3.83,-5.319753847598201
COC(=O)c1c(N[C@]2(C(F)(F)F)[NH+]=C(c3ccccc3)NC2=O)sc2c1CCCCC2,C02863578_decoy,WEE1,Decoy,0.0,-8.50297,-9.45,-1.96,-8.239271948405356
CCOC(=O)c1ccc(-c2ccc([C@H]3N=C(O)c4c(sc5c4CC[NH+](C)C5)N3)o2)cc1,C09065186_decoy,WEE1,Decoy,0.0,-8.39032,-5.31,-0.81,-4.524588994131746
COc1ccc([C@H]2[C@H]3CCCC[C@@]3(O)CC[NH+]2CC(=O)Nc2ccc(C)cc2)cc1OC,C02401950_decoy,WEE1,Decoy,0.0,-8.87797,-8.69,-4.28,-8.148577682898576
COc1ccc(OC)c([C@H]2[C@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc(C)cc2)c1,C09281049_decoy,WEE1,Decoy,0.0,-7.69209,-5.24,-1.76,-5.477544532512205
COc1ccc([C@H]2[C@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc(C)cc2)c(OC)c1,C09304862_decoy,WEE1,Decoy,0.0,-8.99503,-8.96,-3.7,-7.556958037743132
Cc1c(C(=O)NCC2([NH+]3CCCCC3)CCCC2)sc2ncnc(N[C@H]3CCOC3)c12,C12281962_decoy,WEE1,Decoy,0.0,-9.91692,-8.34,-3.55,-7.791157146780842
O=C(Nc1ccc2n(c1=O)C[C@H]1C[C@@H]2C[NH+](Cc2ccc(F)cc2)C1)NC1CCCCC1,C04260364_decoy,WEE1,Decoy,0.0,-8.94519,-6.96,-5.49,-4.453495742807276
Cc1ccccc1-n1c(-c2ccc(Cl)cc2)nn(C[NH+]2CCCC[C@@H]2C(N)=O)c1=S,C13071551_decoy,WEE1,Decoy,0.0,-8.02654,-8.48,-3.26,-10.954663952464882
COc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3[NH2+]Cc2cc(Cl)c(O)c(OC)c2)cc1,C14962356_decoy,WEE1,Decoy,0.0,-9.33477,-8.53,-1.78,-7.680398014193942
CC[NH+]1CCc2c(sc(-n3cccc3)c2[C@H](C)NC(=O)Nc2cc(C)ccc2OC)C1,C20386448_decoy,WEE1,Decoy,0.0,-7.70345,-8.28,-2.59,-7.755640331305397
Cc1ccc(C2(c3noc(CN4CCC(C(N)=O)([NH+]5CCCCC5)CC4)n3)CCCC2)cc1,C20600085_decoy,WEE1,Decoy,0.0,-8.49706,-5.41,-3.53,-5.373398283610465
C[NH+]1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2c[nH]c4ccccc24)N3)CC1,C20720128_decoy,WEE1,Decoy,0.0,-8.14017,-9.57,-2.45,-6.806493911970183
O=C(CN1CC[NH+](CC(=O)Nc2cccc(C(F)(F)F)c2)CC1)Nc1ccc(F)cc1,C20767172_decoy,WEE1,Decoy,0.0,-7.71568,-7.52,-2.9,-6.054831653136803
COc1ccc(C(=O)Oc2ccc([C@@H]3N=C(O)c4c(sc5c4CC[NH+](C)C5)N3)cc2)cc1,C33168182_decoy,WEE1,Decoy,0.0,-9.07771,-9.49,-1.04,-7.123072111146944
Cc1ccccc1NC(=O)Nc1ccc(N2CCCN(C(=O)c3ccc(F)cc3)CC2)[nH+]c1,C35842796_decoy,WEE1,Decoy,0.0,-8.86686,-5.58,-3.25,-5.125304553457971
Cc1ccc(NC(=O)[C@@H](C2CCCC2)[NH+]2CCN(C(=O)Nc3ccc(F)cc3)CC2)cc1,C36311047_decoy,WEE1,Decoy,0.0,-9.27575,-9.14,-2.34,-8.690214973395227
CCOC(=O)c1c(NC(=O)[C@H]2COc3ccccc3O2)sc2c1CC(C)(C)[NH2+]C2(C)C,C08860078_decoy,WEE1,Decoy,0.0,-8.56789,-9.11,-2.13,-8.155605911621755
COc1ccc([C@@H](Nc2cccc(C)[nH+]2)c2c(NC(=O)c3ccco3)sc(C)c2C)cc1,C38547548_decoy,WEE1,Decoy,0.0,-8.91016,-7.99,-4.14,-8.505397313324542
COc1ccccc1[C@@H](Nc1cccc(C)[nH+]1)c1c(NC(=O)c2ccco2)sc(C)c1C,C38547556_decoy,WEE1,Decoy,0.0,-10.6948,-8.97,-2.01,-10.289957107408046
CN(C)c1ccc([C@H](CNC(=O)Nc2ccc(C(C)(C)C)cc2)N2CC[NH+](C)CC2)cc1,C38636922_decoy,WEE1,Decoy,0.0,-8.18543,-8.6,-0.94,-8.95473009904251
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)N[C@H]2C[C@@H]2c2ccccc2)C2(CC[NH2+]CC2)C1,C39602539_decoy,WEE1,Decoy,0.0,-9.24599,-10.62,-2.72,-10.967979351051934
CCOc1ccccc1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2ccc(C)cc2)C2(CC[NH2+]CC2)C1,C39639315_decoy,WEE1,Decoy,0.0,-7.75865,-8.52,-3.3,-7.862303503185198
C[C@@H](CNC(=O)[C@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665178_decoy,WEE1,Decoy,0.0,-8.85545,-8.4,-4.31,-5.670350941298355
C[C@H](CNC(=O)[C@H]1CN(C(=O)C2(C)CCCCC2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665179_decoy,WEE1,Decoy,0.0,-9.32157,-8.54,-3.43,-8.724816203884435
COc1ccc(CC[C@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(C)c(F)c3)CC23CC[NH2+]CC3)cc1,C39675311_decoy,WEE1,Decoy,0.0,-9.68088,-10.17,-3.32,-9.21831976906657
COc1cccc([C@@H](C)NC(=O)[C@@H]2CN(C(=O)C3(C)CCCCC3)CC23CC[NH2+]CC3)c1,C39676712_decoy,WEE1,Decoy,0.0,-7.93788,-7.07,-2.58,-7.146656149422125
Cc1ccsc1CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)CC12CC[NH2+]CC2,C39677318_decoy,WEE1,Decoy,0.0,-8.50853,-7.49,-2.2,-7.033985188448367
CC1(C(=O)N2C[C@@H](C(=O)NCc3ccc(-c4ccccn4)s3)C3(CC[NH2+]CC3)C2)CCCCC1,C39677661_decoy,WEE1,Decoy,0.0,-9.29904,-6.04,-2.76,-5.982486222915717
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCc2ccccc2N2CCCCC2)C2(CC[NH2+]CC2)C1,C39678226_decoy,WEE1,Decoy,0.0,-8.97895,-6.05,-2.49,-6.732838092016284
CC(C)[C@@H](Oc1ccccc1)C(=O)N1C[C@H](C(=O)N[C@@H](C)C(C)(C)C)C2(CC[NH2+]CC2)C1,C39684688_decoy,WEE1,Decoy,0.0,-8.1017,-7.9,-2.45,-5.456975544451109
C[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)NC1(C#N)CCCCC1,C39947174_decoy,WEE1,Decoy,0.0,-8.83747,-8.13,-1.21,-7.685031566708222
O=C(Nc1ccc(N2CCCN(C(=O)c3ccccc3)CC2)[nH+]c1)Nc1ccc(F)c(F)c1,C40415847_decoy,WEE1,Decoy,0.0,-7.51235,-6.81,-3.15,-4.606835142756082
CC[NH+]1CCN(c2ccc(NC(=O)CNC(=O)c3ccc(C(F)(F)F)cc3)c(C)c2)CC1,C45811942_decoy,WEE1,Decoy,0.0,-7.41648,-8.7,-2.71,-7.25057174210963
Cc1ccc(NC(=O)N2CCC3(CC2)[NH2+][C@@H](C(C)C)C(=O)N3Cc2ccc(F)cc2)cc1,C36014205_decoy,WEE1,Decoy,0.0,-7.46536,-4.43,-1.76,-4.425063421578755
C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)NC[C@@H](c2cccs2)[NH+]2CCCC2)cc1,C59357406_decoy,WEE1,Decoy,0.0,-9.65323,-9.66,-2.0,-8.771319208280076
CC[NH+]1CCc2c(sc3c2C(O)=N[C@H](c2ccc(OC(=O)c4ccc(C)cc4)cc2)N3)C1,C15947410_decoy,WEE1,Decoy,0.0,-8.2886,-10.15,-3.53,-8.07304904102521
C[C@H](S[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1cc(F)ccc1F,C39937772_decoy,WEE1,Decoy,0.0,-9.11039,-8.95,-2.3,-8.134215644011162
CC(=O)c1c(C)[nH]c(C(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)c2ccc(N(C)C)cc2)c1C,C63209075_decoy,WEE1,Decoy,0.0,-9.56167,-9.74,-2.81,-8.550914462993878
COc1ccc([C@@H]2N/C(=C\C(=O)N[C@H](C)CC3=c4ccccc4=[NH+]C3)CS2)cc1OC,C63280093_decoy,WEE1,Decoy,0.0,-9.77187,-8.67,-2.32,-8.234093444005934
COc1ccc([C@H]2N/C(=C\C(=O)N[C@@H](C)CC3=c4ccccc4=[NH+]C3)CS2)cc1OC,C63280094_decoy,WEE1,Decoy,0.0,-9.60116,-8.7,-1.67,-8.629338225166894
O=C(CCNC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2C1)Nc1ccc(OC(F)(F)F)cc1,C63294672_decoy,WEE1,Decoy,0.0,-6.08507,-9.44,-3.78,-6.555153614261483
C=C1C=C(O)[C@@H](C(=O)O[C@H](C)C(=O)C2=c3ccccc3=[NH+]C2)NN1c1ccc(Cl)cc1,C63399421_decoy,WEE1,Decoy,0.0,-9.51623,-5.75,-1.81,-6.084464396598827
CC(C)(C)[C@@H]1NN=C(NC(=O)[C@@H]2CC(=O)N(CCC3=c4cc(Cl)ccc4=[NH+]C3)C2)S1,C63557147_decoy,WEE1,Decoy,0.0,-8.58684,-9.49,-2.66,-7.904018193136912
C[C@@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1C1CC1)C(=O)Nc1c(F)cccc1F,C39995188_decoy,WEE1,Decoy,0.0,-8.9062,-8.21,-2.78,-8.238192600232257
Cc1ccc2c(c1)=C(CCN1C[C@@H](C(=O)NC3=NN[C@H](C4CCCCC4)S3)CC1=O)C[NH+]=2,C63941201_decoy,WEE1,Decoy,0.0,-9.17872,-10.51,-1.89,-8.526373079699502
O=C(NNC(=O)c1ccccc1CSc1nc2ccccc2o1)C1=c2ccccc2=[NH+]C1,C64046760_decoy,WEE1,Decoy,0.0,-8.02683,-8.16,-3.73,-9.195238027615847
O=C(CC1=c2ccccc2=[NH+]C1)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2,C64048348_decoy,WEE1,Decoy,0.0,-9.47802,-9.09,-3.84,-9.248437992677395
Cc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccc(F)cc2)c(C)c1,C65074812_decoy,WEE1,Decoy,0.0,-8.48957,-5.59,-3.08,-5.314435739583137
Cc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2cccc(F)c2)c(C)c1,C65074819_decoy,WEE1,Decoy,0.0,-8.62101,-5.28,-3.56,-5.289683195086539
O=C(NCc1ccc(N2CCCC2)cc1)c1cccc(N2CC[NH2+][C@@H](c3ccccc3)C2)n1,C65256352_decoy,WEE1,Decoy,0.0,-8.82006,-10.04,-0.49,-9.506934963807874
COC(=O)c1c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)sc2c1CCCCCC2,C00670445_decoy,WEE1,Decoy,0.0,-7.94104,-7.23,-2.31,-7.870258139988014
Cc1ccc(S(=O)(=O)c2c(N)n(C[C@H]3CCCO3)c3nc4ccccc4nc23)cc1C,C02431986_decoy,WEE1,Decoy,0.0,-8.51489,-8.39,-1.75,-7.568763434925082
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3F)c2)cc1,C03433559_decoy,WEE1,Decoy,0.0,-8.13566,-9.33,-2.23,-7.846557820408427
Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)c3ccc(C)cc3)c2)cc1,C03451754_decoy,WEE1,Decoy,0.0,-6.16363,-9.4,-2.14,-7.053700710458918
CCc1nnc2sc(-c3ccc(NC(=S)NC(=O)c4ccccc4F)c(C)c3)nn12,C09064577_decoy,WEE1,Decoy,0.0,-9.14337,-7.93,-1.2,-6.994072015882485
COc1ccc([C@H]2Nn3c(C)nnc3S[C@H]2C(=O)Nc2cccc(C(F)(F)F)c2)cc1,C09236845_decoy,WEE1,Decoy,0.0,-8.94527,-5.6,-1.06,-6.850762784140636
COc1ccc([C@@H]2Nn3c(C)nnc3S[C@@H]2C(=O)Nc2cccc(C(F)(F)F)c2)cc1,C09236849_decoy,WEE1,Decoy,0.0,-8.7913,-5.47,-1.74,-6.223373403874274
CNC(=O)c1c(NC(=O)c2sc3ccccc3c2Cl)sc2c1CCN(C(=O)OC)C2,C09325386_decoy,WEE1,Decoy,0.0,-9.70892,-9.71,-0.81,-8.819737990094596
COc1ccc(C(=O)Nc2nc(CC(=O)Nc3nc4ccc(C)cc4s3)cs2)cc1,C09628040_decoy,WEE1,Decoy,0.0,-8.27796,-8.56,-1.69,-7.348849264272817
O=C(CSc1nc2sc3c(c2c(=O)n1C1CCCC1)CCCC3)NC(=O)NC1CC1,C11069857_decoy,WEE1,Decoy,0.0,-8.1817,-7.98,-3.14,-10.859902001925278
O=C(Nc1cccc(NC(=O)C2CCN(C(=O)/C=C/c3ccccc3)CC2)c1)c1ccco1,C11181570_decoy,WEE1,Decoy,0.0,-8.35272,-7.6,-2.82,-5.887795084009576
Cc1ccc2nc(NC(=O)CSc3ccc(NC(=O)c4cccs4)nn3)sc2c1,C11739475_decoy,WEE1,Decoy,0.0,-10.3307,-8.38,-2.21,-9.023104825290869
Cc1sc2nc(SCC(=O)NC(=O)NCC(C)C)n(C3CCCC3)c(=O)c2c1C,C12820483_decoy,WEE1,Decoy,0.0,-6.85543,-7.68,-2.37,-6.803293726356085
CC(=O)N[C@H]1[C@H](Oc2ccc(C(C)(C)C)cc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1O,C13369739_decoy,WEE1,Decoy,0.0,-6.78669,-5.96,-2.52,-4.630506446170705
O=C(CSc1ccc(NC(=O)c2cccc(F)c2)nn1)Nc1nc2ccccc2s1,C13701820_decoy,WEE1,Decoy,0.0,-9.48266,-8.07,-2.96,-7.67983140821512
COc1ccc(C(=O)NC(=S)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1Br,C14012043_decoy,WEE1,Decoy,0.0,-8.54096,-8.49,-0.96,-8.769155607063368
CC(=O)Nc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)c1,C14474960_decoy,WEE1,Decoy,0.0,-8.7158,-9.58,-3.93,-5.811376979026617
Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1,C14816773_decoy,WEE1,Decoy,0.0,-7.5023,-10.83,-1.77,-9.381914375806206
COc1ccc(NC(=O)c2sc3c(c2C)[C@@H](c2ccc4c(c2)OCO4)CC(=O)N3)cc1,C15106677_decoy,WEE1,Decoy,0.0,-7.4286,-10.13,-0.62,-7.743860874154802
CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccccc3C(=O)Nc3cccc(C)c3)ccc21,C15245020_decoy,WEE1,Decoy,0.0,-7.34912,-5.44,-4.56,-4.983471304660432
Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(F)cc3)c2)cc1,C15346749_decoy,WEE1,Decoy,0.0,-7.47769,-9.13,-2.09,-7.166149546464919
CC(=O)Nc1cccc(NC(=O)c2ccc(N(C)S(=O)(=O)c3ccc(C)cc3)cc2)c1,C16643927_decoy,WEE1,Decoy,0.0,-9.05579,-8.99,-2.56,-7.918446361909146
NC(=O)c1ccc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)c([N+](=O)[O-])c1,C16804781_decoy,WEE1,Decoy,0.0,-7.74668,-8.83,-3.83,-7.932380388416045
CNC(=O)NC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1CC(C)C)CC[C@@H](C)C3,C21185576_decoy,WEE1,Decoy,0.0,-10.0433,-8.72,-1.75,-8.90104583105657
CNC(=O)NC(=O)[C@H](C)Sc1nc2sc3c(c2c(=O)n1CC(C)C)CC[C@@H](C)C3,C21185580_decoy,WEE1,Decoy,0.0,-9.06934,-8.93,-1.95,-8.66939757525405
CC(C)(C)NC(=O)NC[C@@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2F)CC1,C22851554_decoy,WEE1,Decoy,0.0,-8.7086,-7.86,-3.57,-7.666867375725893
CC(=O)N(c1nc(CSc2nnc(C(F)(F)F)n2N)cs1)c1ccc(C)cc1C,C24609499_decoy,WEE1,Decoy,0.0,-7.76197,-8.18,-0.59,-7.795972248378296
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2cccc(NC(=O)C(C)(C)C)c2)cc1,C25468289_decoy,WEE1,Decoy,0.0,-8.85081,-9.63,-2.21,-9.314680557815358
CC(=O)N(c1ccccc1)c1nc(/C=C/C(=O)NNC(=O)c2ccc(Cl)cc2)cs1,C27771844_decoy,WEE1,Decoy,0.0,-9.19351,-8.11,-2.07,-9.737052888414826
O=C(Nc1cccc(Oc2cnccn2)c1)c1cc(-c2ccc(Br)cc2)n[nH]1,C33137248_decoy,WEE1,Decoy,0.0,-8.5095,-9.01,-0.54,-7.491089040445598
CC(=O)Nc1ccc(NC(=O)c2ccccc2N(C)S(=O)(=O)c2ccc(C)cc2)cc1,C01118485_decoy,WEE1,Decoy,0.0,-7.48468,-8.23,-1.95,-7.907482504138878
Cc1ccc(S(=O)(=O)[C@H](CNC(=O)Nc2ccc3c(c2)OCO3)c2cccs2)cc1,C38935271_decoy,WEE1,Decoy,0.0,-8.61753,-6.82,-2.33,-6.395632857521726
CC(C)(C)[C@@H]1CCC2=C(C1)S[C@H](NC(=O)CSc1nc(-c3ccco3)n[nH]1)[C@@H]2C#N,C39964419_decoy,WEE1,Decoy,0.0,-9.73116,-7.46,-3.15,-8.199208485909244
O=S1(=O)CC[C@H](Nc2ccc(Oc3ccc(N[C@H]4CCS(=O)(=O)C4)cc3)cc2)C1,C40177531_decoy,WEE1,Decoy,0.0,-9.59123,-6.06,-0.74,-5.329750572875572
Cc1c(C(=O)Nc2ccccc2F)oc2c1/C(=N/NS(=O)(=O)c1ccccc1)CCC2,C40814981_decoy,WEE1,Decoy,0.0,-9.85277,-10.63,-2.68,-14.050846282977764
COC(=O)NC(=O)c1c(NC(=O)c2ccc(C(=O)c3ccccc3)cc2)sc(C)c1C,C43898582_decoy,WEE1,Decoy,0.0,-8.20245,-8.52,-1.98,-9.531553308277932
Cc1nc(C)c(-c2nnc(SCc3nc(N)c4c5c(sc4n3)C[C@@H](C)CC5)o2)s1,C45936509_decoy,WEE1,Decoy,0.0,-10.4429,-9.0,-1.59,-10.621432520553917
C[C@H](NC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1)c1nc2ccccc2[nH]1,C46621350_decoy,WEE1,Decoy,0.0,-8.18107,-8.13,-2.78,-6.958001897604537
CS(=O)(=O)[N-]c1nn2c([nH+]1)N[C@@H](c1ccc(Cl)cc1)C[C@H]2c1ccc(Cl)cc1,C06116382_decoy,WEE1,Decoy,0.0,-7.7079,-4.26,-2.85,-4.367686501008727
COC(=O)c1c(NC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)sc2c1CCCCC2,C58908331_decoy,WEE1,Decoy,0.0,-9.97407,-8.97,-1.06,-8.744733703066679
CC(/C=C/c1ccc(N(C)C)cc1)=N\N=C1\NC(=O)C[C@@H](C(=O)Nc2ccccc2)S1,C27569784_decoy,WEE1,Decoy,0.0,-8.74421,-6.77,-3.72,-5.664913901329161
O=C(Nc1cccc(-c2nnc(-c3cccc(NC(=O)C(F)(F)F)c3)o2)c1)C(F)(F)F,C33422175_decoy,WEE1,Decoy,0.0,-7.28534,-10.0,-3.42,-11.38481147469438
Cc1ccc(-n2nnc(C(=O)Nc3ccccc3C(=O)N[C@H](C)c3ccccc3)c2C)cc1,C59740540_decoy,WEE1,Decoy,0.0,-8.78068,-11.14,-0.7,-13.966191254185444
CN(CC(=O)N1CCc2cc(S(N)(=O)=O)ccc21)c1ccc(Oc2ccccc2)cc1,C60342966_decoy,WEE1,Decoy,0.0,-8.4651,-6.75,-3.57,-6.932050986416976
CC(C)(C)[C@H]1CCc2sc(C(=O)NCC(=O)Nc3ccc(-n4cncn4)cc3)cc2C1,C60364016_decoy,WEE1,Decoy,0.0,-9.44998,-8.65,-1.0,-7.966833858846611
O=C(Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1)c1cccc(OC(F)F)c1,C09254735_decoy,WEE1,Decoy,0.0,-7.01585,-9.39,-2.18,-11.505192981147632
CC(C)Oc1ccc(C(=O)N[C@]2(C(F)(F)F)N=C(O)N(C3CCCCCC3)C2=O)cc1,C02595210_decoy,WEE1,Decoy,0.0,-7.34693,-6.06,-2.09,-4.669819804491261
CC(C)c1ccc(C2=C[C@@H]3C(=O)N=N[C@H](SCC(=O)Nc4ccc(F)cc4)N3N2)cc1,C64701153_decoy,WEE1,Decoy,0.0,-8.4746,-9.03,-1.33,-8.097163880458362
Cc1ccc(C)c(NC(=O)N2CCC[C@@H]2c2nnc(C(=O)Nc3cccc(F)c3)s2)c1,C64930348_decoy,WEE1,Decoy,0.0,-7.68575,-9.8,-2.68,-8.236706133621164
Cc1ccc(NC(=O)c2nnc([C@@H]3CCCN3C(=O)Nc3ccc(C)cc3C)s2)cc1,C64930616_decoy,WEE1,Decoy,0.0,-7.56359,-9.56,-4.27,-8.83062668085497
COc1cc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc(Cl)c1OCc1ccccc1F,C02837785_decoy,WEE1,Decoy,0.0,-8.11743,-10.17,-1.13,-8.418649071932894
CC1(C)CC(=O)C2=C(C1)N(c1ccccc1C(F)(F)F)C(N)=C(C#N)[C@H]2c1cccc([N+](=O)[O-])c1,C00713530_decoy,WEE1,Decoy,0.0,-7.50077,-5.51,-2.98,-4.335015235365621
COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)ccc1OCc1ccccc1,C00989001_decoy,WEE1,Decoy,0.0,-8.33757,-6.59,-3.5,-4.888851540590958
Cc1ccc(S(=O)(=O)NC(=O)N(O)[C@@H]2N(Cc3ccc(F)cc3)C(=S)SC2(C)C)cc1,C08934571_decoy,WEE1,Decoy,0.0,-9.96777,-7.79,-2.93,-8.302971498201892
O=C(Nc1ccccc1F)[C@@H]1Sc2nnc(COc3ccccc3)n2N[C@H]1c1ccc(F)cc1,C09295269_decoy,WEE1,Decoy,0.0,-8.37311,-7.85,-0.66,-6.6181233874444025
O=C(Nc1ccccc1F)[C@H]1Sc2nnc(COc3ccccc3)n2N[C@@H]1c1ccc(F)cc1,C09295270_decoy,WEE1,Decoy,0.0,-8.50092,-8.63,-0.62,-8.27725983707778
COC(=O)NC(=O)c1c(NC(=O)c2ccc(C(=O)c3ccccc3)cc2)sc2c1CC[C@@H](C)C2,C09298062_decoy,WEE1,Decoy,0.0,-9.64344,-10.46,-1.56,-9.050152576587672
COc1ccc([C@@H]2CC(c3ccc4ccccc4c3)=NN2C(=O)CSc2nnc(N)s2)cc1,C09442708_decoy,WEE1,Decoy,0.0,-10.1825,-8.5,-3.15,-8.667510115447932
Cc1ccc(S(=O)(=O)N2CCCc3ccc(NC(=O)C(=O)Nc4ccc(C)cc4C)cc32)cc1,C09739238_decoy,WEE1,Decoy,0.0,-8.58776,-9.22,-3.45,-7.743515101281513
Nc1nc(COC(=O)C2CCN(C(=O)c3cccs3)CC2)nc2sc3c(c12)CCCCC3,C10536333_decoy,WEE1,Decoy,0.0,-9.83695,-9.32,-0.92,-8.169401184636463
O=C(Nc1ccc(Br)cc1)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1,C12605404_decoy,WEE1,Decoy,0.0,-8.41473,-9.77,-2.09,-8.239492081344693
O=C1N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1CC(=O)N1c2ccccc2SC[C@@H]1c1ccccc1,C12796292_decoy,WEE1,Decoy,0.0,-7.02727,-7.43,-2.66,-5.94484297939126
C[C@H](Nc1cccc(S(=O)(=O)N2CCCC2)c1)C(=O)Nc1sc2c(c1C#N)CCCCC2,C12609247_decoy,WEE1,Decoy,0.0,-9.3106,-8.11,-2.37,-8.062018869388455
O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1,C12661862_decoy,WEE1,Decoy,0.0,-8.11077,-11.33,-4.11,-7.481707482176724
CNC(=O)NC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1-c1ccccc1F)CC[C@H](C)C3,C10812230_decoy,WEE1,Decoy,0.0,-9.97487,-5.24,-2.31,-5.986262549179839
CCNC(=O)NC(=O)[C@H](C)Sc1nc2sc3c(c2c(=O)n1-c1ccccc1F)CCCC3,C09332305_decoy,WEE1,Decoy,0.0,-8.92395,-9.18,-3.85,-9.652401692376754
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)cc2)C1,C17157807_decoy,WEE1,Decoy,0.0,-8.407,-9.48,-4.16,-6.712651702650168
Cc1cc(Br)c(NCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c(Br)c1,C03096834_decoy,WEE1,Decoy,0.0,-7.44693,-8.58,-1.51,-6.984309415748698
COc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)cc2)cc1,C20571800_decoy,WEE1,Decoy,0.0,-10.2394,-10.23,-2.43,-11.728378631065349
Cn1nc(C(F)(F)F)cc1C(=O)Nc1ccc(S(=O)(=O)NC23CC4CC(CC(C4)C2)C3)cc1,C04173456_decoy,WEE1,Decoy,0.0,-8.52798,-8.6,-3.63,-7.167598329417878
CC(C)CN(C(=O)CSc1nc(N)c2c3c(sc2n1)C[C@H](C)CC3)[C@H]1CCS(=O)(=O)C1,C21228568_decoy,WEE1,Decoy,0.0,-11.0458,-8.94,-0.42,-13.242748983704734
CC(C)CN(C(=O)CSc1nc(N)c2c3c(sc2n1)C[C@@H](C)CC3)[C@@H]1CCS(=O)(=O)C1,C21228572_decoy,WEE1,Decoy,0.0,-9.06059,-8.07,-0.84,-13.71951729904375
Cc1ccc(-c2nnc(SCC(=O)N3N=C(c4cccs4)C[C@H]3c3cccs3)n2N)cc1,C21373015_decoy,WEE1,Decoy,0.0,-9.27387,-6.16,-3.15,-5.984709673378956
Cc1ccc(C)c(NS(=O)(=O)c2cc(C(=O)Nc3ccc(N4CCCC4=O)cc3)ccc2C)c1,C22511010_decoy,WEE1,Decoy,0.0,-8.26259,-11.1,-2.26,-11.25083384781506
Cc1cc(C)cc(NS(=O)(=O)c2cc(C(=O)Nc3ccc(N4CCCC4=O)cc3)ccc2C)c1,C22534051_decoy,WEE1,Decoy,0.0,-8.85549,-9.75,-3.36,-7.449045056702601
CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)c3ccc(N4CCCS4(=O)=O)cc3)cc2C1,C24352171_decoy,WEE1,Decoy,0.0,-10.6862,-10.38,-3.16,-8.444098113936903
CCSc1sc(CC)cc1[C@H]1C(C#N)=C(N)N(c2ccc([N+](=O)[O-])cc2)C2=C1C(=O)CCC2,C27550678_decoy,WEE1,Decoy,0.0,-8.05923,-4.14,-2.55,-4.668013086718127
Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C(=O)NCc3cccnc3)CCCC4)no2)cc1,C27662601_decoy,WEE1,Decoy,0.0,-9.45496,-9.59,-3.36,-9.668675134015691
CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)[C@@H]2CCCN(c3nc4ccccc4s3)C2)c1,C32932213_decoy,WEE1,Decoy,0.0,-9.86249,-9.21,-3.69,-8.467348757564261
Cc1nn(-c2ccccc2)c(N2CCC(C(=O)Nc3cc(F)ccc3F)CC2)c1NC(=O)C(C)C,C33069412_decoy,WEE1,Decoy,0.0,-7.85022,-5.38,-2.56,-5.139495327665673
O=C(Nc1ccc(F)cc1)c1nnc([C@@H]2CCCN(C(=O)Nc3cc(Cl)ccc3Cl)C2)s1,C33113079_decoy,WEE1,Decoy,0.0,-7.5719,-5.97,-2.57,-4.2897851092880535
Cc1ccc(NC(=O)c2nnc([C@@H]3CCCN(C(=O)Nc4cc(Cl)ccc4C)C3)s2)cc1,C33113309_decoy,WEE1,Decoy,0.0,-9.13618,-8.94,-3.09,-8.50271361774068
C[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)Nc2ccccc2)CCN1C(=O)C1CCCCC1,C34978245_decoy,WEE1,Decoy,0.0,-7.80203,-6.47,-3.9,-4.35970782899561
CC[C@H](C)[C@H](NC(=O)c1ccc(Br)cc1)C(=O)N1CCN(C(=O)NC(C)C)[C@H](C)C1,C35097933_decoy,WEE1,Decoy,0.0,-7.89369,-4.9,-2.34,-3.254295065490864
NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1,C36386860_decoy,WEE1,Decoy,0.0,-7.76428,-8.04,-2.33,-6.379738335030703
COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3oc4ccc(F)cc4c3C)ccc21,C38687269_decoy,WEE1,Decoy,0.0,-9.57941,-10.65,-1.45,-8.76123446054777
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1nc(-c3cc(Cl)sc3Cl)cs1)C2=O,C39517953_decoy,WEE1,Decoy,0.0,-10.4706,-10.01,-2.2,-8.61092335223974
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)C1=O,C39548331_decoy,WEE1,Decoy,0.0,-6.63776,-9.23,-2.85,-7.758974981057061
C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)C1=O,C39548332_decoy,WEE1,Decoy,0.0,-7.27307,-10.3,-3.18,-7.634368783219692
CC(=O)Nc1ccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3cccc(Cl)c3)c2)cc1C,C45950153_decoy,WEE1,Decoy,0.0,-9.34735,-9.92,-3.85,-7.921500457284118
N#Cc1c(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@@H](c2ccco2)N3)sc2c1CCCCC2,C00674761_decoy,WEE1,Decoy,0.0,-9.37304,-6.93,-1.98,-6.557615013745945
COc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)Nc4ccc(C)c(C)c4)cc3N2)cc1OC,C03011009_decoy,WEE1,Decoy,0.0,-8.33774,-10.48,-2.4,-10.653763970940858
COc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)Nc4cc(C)cc(C)c4)cc3N2)cc1OC,C03012106_decoy,WEE1,Decoy,0.0,-8.37521,-9.67,-1.6,-6.693166996752957
COc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)Nc4ccc(C)cc4C)cc3N2)cc1OC,C03012148_decoy,WEE1,Decoy,0.0,-8.02448,-9.24,-2.98,-6.408881868436785
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)Nc4ccc(C)cc4C)cc3N2)cc1OC,C03012150_decoy,WEE1,Decoy,0.0,-8.20033,-8.47,-2.0,-6.932633063880668
COc1cccc([C@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)Nc4sc5c(c4C#N)CCCC5)c3N2)c1,C00650837_decoy,WEE1,Decoy,0.0,-9.99152,-8.85,-3.86,-8.184928049605963
O=C(Nc1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1)[C@@H]1CCCN1C(=O)C1CCCCC1,C59984777_decoy,WEE1,Decoy,0.0,-8.64392,-9.88,-3.37,-8.175520815821754
CCOCCn1/c(=N/C(=O)c2cc(Cl)sc2Cl)sc2cc(S(N)(=O)=O)ccc21,C13139372_decoy,WEE1,Decoy,0.0,-9.9965,-4.51,-1.86,-5.449839652860302
COc1ccc([C@@H]2C[C@H](C(F)(F)F)n3nc(C(=O)Nc4ccc(F)cc4F)cc3N2)cc1OC,C12848726_decoy,WEE1,Decoy,0.0,-8.77128,-8.31,-1.31,-7.081375213072397
NC(=O)c1nc(-c2ccc(F)c(F)c2)nc2c1n(Cc1ccccc1)c(=O)n2-c1ccc(F)cc1,C64965867_decoy,WEE1,Decoy,0.0,-9.07642,-5.89,-4.17,-5.299087726666105
Cc1cc(C)c(C(=O)c2ccc(C(=O)NNC(=O)NC3(c4ccccc4)CC3)cc2)c(C)c1,C03618800_decoy,WEE1,Decoy,0.0,-8.17713,-8.3,-2.42,-7.722883584764685
C=C1NC(=O)N[C@H](c2ccc(C(C)(C)C)cc2)[C@H]1C(=O)Nc1cccc(C(F)(F)F)c1,C03251520_decoy,WEE1,Decoy,0.0,-8.79709,-6.75,-3.76,-6.343341836175396
Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C(N)=O)CCCCC4)c3ccccc3n2)s1,C00672931_decoy,WEE1,Decoy,0.0,-8.63484,-5.85,-3.61,-5.82122642052967
Cc1ccc(C(C)C)c(OCC(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C(C)(C)C)C3)c1,C08832438_decoy,WEE1,Decoy,0.0,-9.60429,-8.71,-1.04,-8.56522390540919
CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=O)c3cc4ccccc4o3)cc2O)cc1,C08907264_decoy,WEE1,Decoy,0.0,-8.58467,-8.95,-2.2,-12.946409184642793
Nn1c(S[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)nnc1-c1ccc(F)cc1,C08943225_decoy,WEE1,Decoy,0.0,-7.60709,-7.31,-2.04,-5.929328094126267
Cc1cccc(C(=O)NC(=S)Nc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)c1,C01171412_decoy,WEE1,Decoy,0.0,-8.51053,-6.11,-1.8,-5.289122533088818
CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=S)NC(=O)c3cccs3)cc2)cc1,C01176821_decoy,WEE1,Decoy,0.0,-9.03998,-9.33,-3.37,-7.855567053941439
C[C@@H](NC(=O)c1ccccc1NC(=S)NC(=O)c1cc(Cl)cc(Cl)c1)c1ccccc1,C10505479_decoy,WEE1,Decoy,0.0,-10.7497,-9.48,-3.97,-10.813884926911308
O=C(Nc1ccc(N[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cc1)C1CC1,C10768220_decoy,WEE1,Decoy,0.0,-7.21777,-8.22,-2.95,-6.551527774972045
Cc1ccc(C(=O)c2c(N)c(C(=O)Nc3ccc(Br)cc3)c3ccccn23)cc1,C12342071_decoy,WEE1,Decoy,0.0,-8.20143,-9.98,-0.9,-8.020598382685922
Cc1c(Cl)c(C)c(Cl)c(OCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c1Cl,C14273351_decoy,WEE1,Decoy,0.0,-9.99543,-8.72,-0.84,-9.107634505813593
CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc(Br)ccc1O)N2,C14460944_decoy,WEE1,Decoy,0.0,-7.88911,-8.41,-1.4,-7.164330460394181
Cc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2ccccc2O)N3)c(C)c1,C14474059_decoy,WEE1,Decoy,0.0,-9.72242,-10.24,-2.72,-9.973621960610338
Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2ccccc2O)N3)c1,C14474067_decoy,WEE1,Decoy,0.0,-9.91955,-9.2,-3.58,-10.66618077734617
O=S(=O)(NC1CCCCC1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1c[nH]c3ccccc13)N2,C14544578_decoy,WEE1,Decoy,0.0,-8.21591,-10.68,-1.72,-7.635624697318676
O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2,C14544861_decoy,WEE1,Decoy,0.0,-10.3935,-10.85,-2.62,-9.561190985592336
O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2,C14544862_decoy,WEE1,Decoy,0.0,-7.75748,-10.04,-2.56,-7.3748754931451455
Cc1cccc(NC(=O)c2cccc(NC(=S)NC(=O)/C=C/c3ccc(Cl)cc3)c2)c1,C14564093_decoy,WEE1,Decoy,0.0,-10.5015,-9.64,-1.62,-9.2325652794624
CCCC(=O)N[C@@H](NC(=S)Nc1sc2c(c1C#N)CCCC2)C(Cl)(Cl)Cl,C15636939_decoy,WEE1,Decoy,0.0,-11.5507,-7.52,-1.17,-9.28571568958104
Cc1ccc(/C=N/NC(=O)c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)cc2)cc1,C19909371_decoy,WEE1,Decoy,0.0,-8.06637,-10.41,-3.03,-8.07416628549797
C[C@@H](NC(=O)c1ccc(NC(=S)NC(=O)c2ccc(Cl)cc2Cl)cc1)c1ccccc1,C20119145_decoy,WEE1,Decoy,0.0,-9.11511,-10.74,-2.35,-8.440588961657882
C[C@@H](NC(=O)c1ccc(NC(=S)NC(=O)/C=C/c2cccc3ccccc23)cc1)c1ccccc1,C20119452_decoy,WEE1,Decoy,0.0,-9.4523,-6.53,-2.66,-5.539156851390534
C/C(=C\C(=O)Nc1cc(Cl)cc(Cl)c1)NNC(=O)c1ccc(Cl)cc1Cl,C20158968_decoy,WEE1,Decoy,0.0,-10.2556,-8.89,-2.42,-9.102053083422458
CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc(Br)ccc1O)N2,C20695981_decoy,WEE1,Decoy,0.0,-9.17028,-6.95,-1.56,-5.978893176440413
CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc(Br)ccc1O)N2,C20696413_decoy,WEE1,Decoy,0.0,-10.5306,-8.75,-1.9,-8.505858393051444
O=S(=O)(Nc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1c[nH]c3ccccc13)N2,C20719743_decoy,WEE1,Decoy,0.0,-8.51578,-10.89,-1.81,-7.985940999856957
O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1c[nH]c3ccccc13)N2,C20720219_decoy,WEE1,Decoy,0.0,-9.89771,-8.58,-2.56,-7.833323356845709
Nc1nc(SCC(=O)Nc2ccc(OC(F)F)cc2)nc2sc3c(c12)CCCC3,C21242387_decoy,WEE1,Decoy,0.0,-9.41018,-8.96,-0.87,-8.980017574393589
O=C(CSc1nc2ccccc2s1)Nc1ccc(NC(=O)Nc2ccccc2)cc1,C22456800_decoy,WEE1,Decoy,0.0,-9.79761,-5.94,-2.77,-6.157824282793556
COc1ccc(C(=O)[C@H]2[C@@H](c3ccc(C(C)C)cc3)NC(=O)N[C@@]2(O)C(F)(F)F)cc1,C25581091_decoy,WEE1,Decoy,0.0,-8.2308,-4.92,-3.55,-5.636982282045869
Cc1cccc(C(=O)Nc2ccc(N3CCCC3)c(NC(=O)Nc3ccc(F)cc3)c2)c1,C33009242_decoy,WEE1,Decoy,0.0,-8.40374,-6.26,-1.2,-5.044846016416363
CCc1ccc(NC(=O)Nc2cc(NC(=O)c3ccc(C)cc3)ccc2N2CCCC2)cc1,C33009313_decoy,WEE1,Decoy,0.0,-8.39768,-9.42,-2.17,-9.331559267965009
CC[C@@H](C)NC(=O)c1cc(NC(=O)NC23CC4CC(CC(C4)C2)C3)ccc1N1CCCC1,C33422401_decoy,WEE1,Decoy,0.0,-8.89189,-9.07,-2.94,-7.54524143583206
Cc1ccccc1NC(=O)Nc1ccc(N2CCCC2)c(C(=O)N[C@@H](C)c2ccccc2)c1,C00749033_decoy,WEE1,Decoy,0.0,-7.93942,-9.07,-4.6,-6.995528769158643
C[C@@H](NC(=O)c1cc(NC(=O)NC2CCCCC2)ccc1N1CCCC1)c1ccccc1,C00748990_decoy,WEE1,Decoy,0.0,-8.34749,-5.92,-5.56,-4.818850470926032
Nc1c(NC(=O)Oc2ccccc2)c(-c2ccc(Cl)cc2)nn1-c1cc(F)ccc1F,C34784768_decoy,WEE1,Decoy,0.0,-8.05421,-9.88,-1.86,-8.795257049573852
CC[C@H](C)NC(=O)c1cc(NC(=O)Nc2ccc(F)c(F)c2)ccc1N1CCCCC1,C00748634_decoy,WEE1,Decoy,0.0,-8.75292,-9.05,-4.71,-6.346533171202048
Nc1nc(SCC(=O)Nc2ccccc2Br)nc2sc3c(c12)CCCC3,C36818912_decoy,WEE1,Decoy,0.0,-10.4926,-9.51,0.02,-8.697860727441526
Nc1c(C(=O)c2ccccc2)sc(Nc2ccccc2)c1S(=O)(=O)c1ccccc1,C01004141_decoy,WEE1,Decoy,0.0,-7.85761,-5.64,-0.75,-4.484633371982679
Cc1ccc(C(C)C)c(OC(=O)c2oc3c(c2C)/C(=N/NC(N)=S)CC(C)(C)C3)c1,C39856231_decoy,WEE1,Decoy,0.0,-8.03991,-9.07,-1.76,-7.931418926205122
Nc1cc(-c2cccc(C(F)(F)F)c2)nn1-c1ccc(C(=O)NC2CCCCCC2)cc1,C44947451_decoy,WEE1,Decoy,0.0,-8.64869,-6.44,-3.8,-5.561509112620381
CC1(C)CC(=O)C2=C(C1)Nc1nc(SCc3ccccc3)nc(N)c1[C@@H]2c1cccs1,C44973616_decoy,WEE1,Decoy,0.0,-10.1272,-6.13,-1.41,-7.063135744211797
Cc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(OCc5ccccc5)cc4)c32)s1,C09292103_decoy,WEE1,Decoy,0.0,-9.29621,-5.34,-0.16,-5.197112100745202
O=C(Nc1ccccc1CC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12)[C@H]1CCCO1,C57336358_decoy,WEE1,Decoy,0.0,-9.51129,-9.77,-3.09,-10.545954501797876
Cc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1NC(=S)N[C@@H]1C[C@H]2CC[C@@H]1C2,C16220331_decoy,WEE1,Decoy,0.0,-9.34894,-9.43,-2.99,-10.104615620233272
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1cccc(OCc2ccccc2F)c1,C00622878_decoy,WEE1,Decoy,0.0,-7.76537,-7.84,-1.41,-7.342045484643222
C[C@@H]1CCc2c(sc(NC(=O)C(C)(C)Oc3ccc(C(C)(C)C)cc3)c2C(N)=O)C1,C59294520_decoy,WEE1,Decoy,0.0,-8.94568,-8.81,-1.24,-7.879952651507319
O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CCCCC2)cc1,C12487491_decoy,WEE1,Decoy,0.0,-9.81313,-6.81,-1.44,-6.768356148828422
Cc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(NC(=O)c3ccccc3)c(C)c2)cc1,C66198462_decoy,WEE1,Decoy,0.0,-7.7794,-9.91,-1.62,-7.010630837093866
C/C(=C\c1csc(C)n1)[C@@H]1C[C@@H]2O[C@@H]2CCC[C@H](C)[C@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1,C03951738_decoy,WEE1,Decoy,0.0,-9.47735,-5.79,-3.49,-4.84294114849586
CCSc1ccsc1[C@@H]1C(C#N)=C(N)N(c2cccc([N+](=O)[O-])c2)C2=C1C(=O)CCC2,C02501765_decoy,WEE1,Decoy,0.0,-7.5736,-5.55,-0.9,-4.25797916214818
Cc1cc([C@@H]2C(C#N)=C(N)N(c3cc([N+](=O)[O-])ccc3Cl)C3=C2C(=O)CCC3)c(C)s1,C02501741_decoy,WEE1,Decoy,0.0,-7.09243,-5.34,-0.99,-4.178275365311285
Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(Br)s3)cc2)n1,C00940867_decoy,WEE1,Decoy,0.0,-9.22934,-8.11,-1.8,-6.9071897097886295
O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2)C1)c1ccc(F)cc1,C01347221_decoy,WEE1,Decoy,0.0,-6.81395,-9.2,-3.3,-7.806872407303386
Nc1c(S(=O)(=O)c2ccc(Cl)cc2)c2nc3ccccc3nc2n1/N=C/c1cccs1,C02411007_decoy,WEE1,Decoy,0.0,-9.06302,-5.77,-1.56,-5.140255762799035
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3ccco3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C02414324_decoy,WEE1,Decoy,0.0,-9.14441,-5.02,-4.25,-5.002121386703538
N#CC1=C(N)N(c2ccc([N+](=O)[O-])cc2)C2=C(C(=O)C[C@H](c3ccccc3)C2)[C@H]1c1ccccc1,C08455960_decoy,WEE1,Decoy,0.0,-6.17058,-5.45,-1.37,-4.440765166420123
Nn1c(SCc2nnc(-c3ccc(Cl)cc3)o2)nnc1-c1ccc(Cl)cc1Cl,C08644385_decoy,WEE1,Decoy,0.0,-9.59822,-7.08,-2.1,-6.646177458506187
O=C(NNc1nc2c(F)cc(F)cc2s1)c1ccc(S(=O)(=O)N2CCCCC2)cc1,C09381924_decoy,WEE1,Decoy,0.0,-9.63729,-6.64,-1.56,-7.225048269229637
O=C(COC(=O)c1ncc(Cl)c(Cl)c1Cl)NC(=O)NC12CC3CC(CC(C3)C1)C2,C09642754_decoy,WEE1,Decoy,0.0,-9.49345,-8.44,-2.64,-7.2991966372610015
CCOc1cc2c3c(c1)[C@]1(C(=O)N3C(C)(C)C=C2C)C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2,C02433787_decoy,WEE1,Decoy,0.0,-6.15738,-5.52,-2.98,-3.604603532660096
CC(C)c1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1,C02096283_decoy,WEE1,Decoy,0.0,-6.59992,-6.34,-3.3,-5.136557391651308
O=C(Nc1ccc(F)cc1)N(Cc1cccs1)Cc1cc2cc3c(cc2[nH]c1=O)OCO3,C12710873_decoy,WEE1,Decoy,0.0,-6.53493,-9.03,-2.01,-6.42698384145343
CCc1ccc([C@H]2C(C#N)=C(N)N(c3cc([N+](=O)[O-])ccc3C)C3=C2C(=O)CC(C)(C)C3)s1,C02518444_decoy,WEE1,Decoy,0.0,-6.24785,-6.74,-2.81,-3.81022388021146
Cc1ccc(C)c(-n2ccnc2SCC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)c1,C16125287_decoy,WEE1,Decoy,0.0,-8.16508,-9.33,-2.26,-8.049628860869852
CSc1nnc2c(n1)O[C@@H](c1c[nH]nc1-c1ccccc1)Nc1ccc(Br)cc1-2,C01159664_decoy,WEE1,Decoy,0.0,-8.23299,-5.0,-3.45,-5.04896375258639
O=C(Nc1ccc2c(c1)OCO2)c1cccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1,C17301968_decoy,WEE1,Decoy,0.0,-9.02687,-10.96,-3.49,-10.642176591479476
NC1=C(C(=O)c2ccccc2)[C@H](c2ccccc2)C2=C(CCCC2=O)N1c1ccc([N+](=O)[O-])cc1,C20806539_decoy,WEE1,Decoy,0.0,-6.9187,-10.02,-3.17,-7.702039897788157
O=C(NC(=S)Nc1cccc(-c2nc3cc(Cl)ccc3o2)c1)c1ccc2nsnc2c1,C21596006_decoy,WEE1,Decoy,0.0,-11.5728,-9.98,-2.78,-9.025491684259087
O=C(Nc1c(-c2ccc(F)cc2)nc2sccn12)c1cccc(NC(=O)[C@H]2CCCO2)c1,C22965625_decoy,WEE1,Decoy,0.0,-8.81345,-8.45,-2.7,-8.523026221175849
N#CC1=C(N)N(c2cccc(C(F)(F)F)c2)C2=C(C(=O)CCC2)[C@@H]1c1cccc([N+](=O)[O-])c1,C25781939_decoy,WEE1,Decoy,0.0,-5.88947,-8.02,-0.81,-5.6632423587687954
O=c1[nH]c(NC2CCN(S(=O)(=O)c3ccc(C(F)(F)F)cc3)CC2)nc2c1CCCC2,C15879939_decoy,WEE1,Decoy,0.0,-8.43222,-6.1,-4.01,-4.833562076273958
N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccccc2F)[C@@H]2CN(C(=O)OCc3ccccc3)CC=C12,C09635818_decoy,WEE1,Decoy,0.0,-7.79735,-4.74,-0.78,-4.697059345318349
O=C([O-])c1cc(N2CCN(c3ccc(Cl)cc3)CC2)[nH+]c2ccc(NC(=O)C3CC3)cc12,C33010401_decoy,WEE1,Decoy,0.0,-9.61709,-9.43,-0.99,-7.661921759898984
Cc1ccc(C)c(NC(=O)N2CCC[C@H](c3nnc(C(=O)Nc4ccc(F)cc4)s3)C2)c1,C33106832_decoy,WEE1,Decoy,0.0,-8.16027,-5.6,-3.89,-4.776362050338288
Cc1ccc(NC(=O)N2CCC[C@H](c3nnc(C(=O)Nc4ccc(F)cc4)s3)C2)c(C)c1,C33113030_decoy,WEE1,Decoy,0.0,-9.10709,-5.83,-2.46,-5.55870109515366
O=C(Nc1ccccc1)c1nnc([C@@H]2CCCN(C(=O)Nc3ccccc3C(F)(F)F)C2)s1,C33113515_decoy,WEE1,Decoy,0.0,-8.39321,-8.74,-4.03,-9.56151995339029
CC(C)[C@@H](NC(=O)Nc1ccc(Cl)cc1Cl)C(=O)N1CCN(C(=O)C2CC2)[C@@H](C)C1,C34974539_decoy,WEE1,Decoy,0.0,-8.38906,-6.19,-1.67,-6.152840636218393
Cc1ccc(NC(=O)N2CCC([C@@H](NC(=O)c3cccs3)C(=O)N3CCCC3)CC2)cc1,C36213900_decoy,WEE1,Decoy,0.0,-9.21224,-7.26,-3.66,-7.57398462529696
C[C@@H]1Sc2ccc(S(=O)(=O)N3CCC(C(=O)Nc4ccc(Cl)cc4)CC3)cc2NC1=O,C09265884_decoy,WEE1,Decoy,0.0,-9.39655,-5.8,-3.8,-5.225803254233259
CC1=C2[C@@H](c3cn(-c4ccccc4)nc3C34CC5CC(CC(C5)C3)C4)C(C#N)=C(N)O[C@H]2N=N1,C38582626_decoy,WEE1,Decoy,0.0,-7.88037,-5.46,-1.62,-4.403846961885677
N#CC1=C(N)Oc2cc(OC(=O)c3cc4ccccc4oc3=O)ccc2[C@H]1c1ccccc1F,C38687934_decoy,WEE1,Decoy,0.0,-8.31871,-11.05,-0.66,-8.199538638475737
OC(c1ccccc1)(c1ccccc1)c1nnc2n1N[C@@H]([C@@H]1C=C(c3ccccc3)N=N1)S2,C38745157_decoy,WEE1,Decoy,0.0,-7.78391,-4.64,-5.17,-4.417404252705614
COc1ccc([C@H]2C(C#N)=C(N)OC3=NN=C(c4ccc(Br)cc4)[C@@H]32)cc1OC,C00987200_decoy,WEE1,Decoy,0.0,-8.3928,-8.29,-1.08,-8.750879263036346
O=C(Nc1cccc2cn[nH]c12)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1,C39555278_decoy,WEE1,Decoy,0.0,-7.57971,-5.56,-3.12,-4.129639086987488
O=C(Nc1ccc(C(=O)Nc2nnc(-c3ccccc3)o2)cc1)c1ccc(Br)cc1,C39761515_decoy,WEE1,Decoy,0.0,-8.14076,-9.21,-1.3,-6.776311346051655
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)sc(C)c1C,C43898541_decoy,WEE1,Decoy,0.0,-9.24305,-6.76,-3.79,-5.989834507805892
C/C(=C\c1csc(C)n1)[C@H]1C[C@@H]2O[C@H]2CCC[C@H](C)[C@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1,C44136281_decoy,WEE1,Decoy,0.0,-9.64683,-6.43,-0.88,-5.50110003202138
O=C1CN(c2ccc(NC(=O)[C@@H]3CCCN(C(=O)c4ccc(Cl)c(Cl)c4)C3)cc2)CCN1,C46815487_decoy,WEE1,Decoy,0.0,-9.99418,-12.05,-1.91,-9.078094589601127
O=C1CN(c2ccc(NC(=O)[C@H]3CCCN(C(=O)c4ccc(Cl)c(Cl)c4)C3)cc2)CCN1,C46815489_decoy,WEE1,Decoy,0.0,-10.0204,-5.69,-3.96,-5.408425947203824
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccccc4)N[C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C15958228_decoy,WEE1,Decoy,0.0,-8.61456,-5.2,-1.61,-5.047741121871285
CC1=C(C(=O)Nc2ccc(Oc3ccccc3)cc2)[C@@H](c2ccc(F)cc2)n2nc(C)nc2N1,C22537468_decoy,WEE1,Decoy,0.0,-9.15087,-10.28,-2.7,-8.62301867187636
C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1CC[NH+](Cc2nc([O-])c3sccc3n2)CC1,C22783320_decoy,WEE1,Decoy,0.0,-10.7725,-8.85,-1.97,-9.81359073712268
Cc1ccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@H](c2ccc4c(c2)OCO4)N3)c(C)c1,C03012268_decoy,WEE1,Decoy,0.0,-8.71932,-5.56,-1.9,-4.959843530821622
Cc1ccc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@@H](c2ccc4c(c2)OCO4)N3)c(C)c1,C03012269_decoy,WEE1,Decoy,0.0,-8.00884,-6.16,-1.38,-5.383498514615763
O=C(CSc1nc2ccc([N+](=O)[O-])cc2[nH]1)Nc1ccc(I)cc1,C18222551_decoy,WEE1,Decoy,0.0,-8.90689,-5.42,-2.32,-6.054691354919201
COC(=O)c1ccc([C@@H]2C(C#N)=C(N)OC3=NN=C(c4ccc(Br)cc4)[C@H]32)cc1,C16293207_decoy,WEE1,Decoy,0.0,-8.75332,-6.82,0.05,-8.803524214203724
O=C(NC1CCCCC1)c1ccc2c(=O)nc3n(c2c1)C(=S)S[C@H]3C(=O)NC1CCCC1,C63704771_decoy,WEE1,Decoy,0.0,-9.19518,-7.54,-0.39,-6.0482718177741015
C=CCN1C(=O)[C@]2(C(C#N)=C(N)OC3=NN=C(CSc4ccc(C)cc4)[C@H]32)c2ccccc21,C08442119_decoy,WEE1,Decoy,0.0,-7.67369,-4.73,-2.18,-4.5353382235852
C#CCN(C)C(=O)[C@@H](C)[C@@H]1CC[C@]2(C)Cc3sc(NC(=O)c4cccn4C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840979_decoy,WEE1,Decoy,0.0,-9.90187,-5.17,-2.8,-4.994789782459667
C#CCN(C)C(=O)[C@@H](C)[C@H]1CC[C@]2(C)Cc3sc(NC(=O)c4cccn4C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840981_decoy,WEE1,Decoy,0.0,-9.64497,-5.22,-2.38,-5.587379445247923
O=C(Nc1ccccc1N1CCCC1=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1,C08965983_decoy,WEE1,Decoy,0.0,-8.64275,-9.21,-3.47,-8.9307066941356
CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CN(C(=O)c2cccs2)CC3)c(C)c1,C08977311_decoy,WEE1,Decoy,0.0,-9.4884,-10.19,-2.48,-9.076900676104197
O=C(NC(=S)Nc1ncccn1)c1cn(-c2ccccc2)nc1-c1ccc(Br)cc1,C03214521_decoy,WEE1,Decoy,0.0,-8.42659,-8.91,-2.49,-7.50217535717614
Cc1cccc(C)c1OCC(=O)Nc1sc2c(c1C(=O)N[C@@H]1CCS(=O)(=O)C1)CCCC2,C09427999_decoy,WEE1,Decoy,0.0,-9.68575,-9.6,-3.21,-9.837652019801997
CCOc1ccc(Br)cc1S(=O)(=O)N1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C,C10519024_decoy,WEE1,Decoy,0.0,-9.51335,-8.05,-2.05,-8.192263594809289
Cc1ccc(N2C(=O)C[C@@H](C(=O)Nc3ccc(NS(C)(=O)=O)cc3)[C@H]2c2cccs2)cc1,C11363177_decoy,WEE1,Decoy,0.0,-8.96343,-4.57,-1.76,-5.954019175828206
O=C(Cc1cccc2ccccc12)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1,C12060029_decoy,WEE1,Decoy,0.0,-8.12465,-6.01,-2.98,-4.763737906244728
O=C(NC1CCCCC1)c1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)cc1,C12429020_decoy,WEE1,Decoy,0.0,-7.92431,-10.11,-2.82,-8.157923149150339
O=C(NC1CCCCC1)c1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)cc1,C12429021_decoy,WEE1,Decoy,0.0,-9.41536,-10.26,-2.56,-12.186540223328691
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC(=O)c3cc4c(s3)CC[C@H](C)C4)CC2)cc1,C12814422_decoy,WEE1,Decoy,0.0,-10.4099,-9.06,-2.59,-8.11187067761372
Cc1cc(C)c(NC(=O)CNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)C[C@H](C)C3)cc2)c(C)c1,C12906964_decoy,WEE1,Decoy,0.0,-8.86567,-8.58,-3.36,-7.290630368052231
O=C(/C=C/c1cccc(Br)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1,C14907932_decoy,WEE1,Decoy,0.0,-8.82146,-9.65,-2.18,-9.089192048655958
C[C@@H](NC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCS(=O)(=O)C2)cc1)C12CC3CC(CC(C3)C1)C2,C15737486_decoy,WEE1,Decoy,0.0,-10.2573,-9.88,-3.06,-8.560176474629941
C[C@H](NC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCS(=O)(=O)C2)cc1)C12CC3CC(CC(C3)C1)C2,C15737487_decoy,WEE1,Decoy,0.0,-9.41626,-8.75,-5.05,-5.579436991755848
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1,C15902305_decoy,WEE1,Decoy,0.0,-9.74615,-9.21,-2.22,-8.758899077949476
CC(=O)Nc1ccc(-c2csc(NC(=O)C3CCN(C(=O)c4ccc(Cl)cc4)CC3)n2)cc1,C15991624_decoy,WEE1,Decoy,0.0,-8.50653,-9.81,-2.09,-7.120229168428893
CC(C)c1ccc(-n2ccnc2SCC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)cc1,C16121166_decoy,WEE1,Decoy,0.0,-9.69941,-8.27,-2.15,-9.341116489158148
Cc1ccc(-c2ccsc2C(=O)OCC(=O)N2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)cc1,C16130447_decoy,WEE1,Decoy,0.0,-8.4974,-10.41,-2.59,-8.502827674521777
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)c1c2ccccc2cc2ccccc12,C16749487_decoy,WEE1,Decoy,0.0,-6.94126,-11.54,-4.56,-11.368089189740196
CC(=O)Nc1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(Br)s3)CC2)cc1,C17302280_decoy,WEE1,Decoy,0.0,-9.67101,-9.35,-3.03,-8.48439044373207
CC(C)(C)c1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)cc1,C17518458_decoy,WEE1,Decoy,0.0,-9.38905,-9.62,-3.0,-10.399427930369937
CCn1c(SCC(=O)Nc2ccc(C(=O)NC)cc2)nc2sc3c(c2c1=O)CC[C@H](C)C3,C18402929_decoy,WEE1,Decoy,0.0,-9.83837,-9.14,-0.57,-18.296319455148232
COc1ccc([C@@H]2C(C(=O)Nc3cccc(C)n3)=C(C)NC3=C2C(=O)C[C@H](c2ccco2)C3)cc1,C13080573_decoy,WEE1,Decoy,0.0,-7.4585,-6.13,-2.73,-5.602441208732079
O=C(N/N=C/c1ccncc1)c1cc2n(n1)[C@H](C(F)(F)C(F)(F)F)C[C@@H](c1ccc(F)cc1)N2,C20602324_decoy,WEE1,Decoy,0.0,-7.33651,-6.85,-1.45,-5.2995178655993085
C=CCNC(=O)NC(=O)CSc1nc2sc3c(c2c(=O)n1-c1ccccc1F)CCCC3,C09332283_decoy,WEE1,Decoy,0.0,-9.85968,-8.8,-1.92,-8.755916100300912
O=C(NC1CC1)[C@@H]1CCCN(C(=O)c2cccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)c2)C1,C21710596_decoy,WEE1,Decoy,0.0,-8.2486,-9.03,-3.47,-8.307619563794871
O=C(NC1CC1)[C@H]1CCCN(C(=O)c2cccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)c2)C1,C21710601_decoy,WEE1,Decoy,0.0,-8.45689,-10.89,-3.39,-8.515936709454603
CC(C)Cn1c(SCC(=O)N2CCC(C(N)=O)CC2)nc2sc3c(c2c1=O)CC[C@H](C)C3,C22668050_decoy,WEE1,Decoy,0.0,-9.50251,-8.46,-4.37,-5.191044309663916
Cc1sc2nc(CN3CCN(S(=O)(=O)c4ccc(C(C)(C)C)cc4)CC3)nc(N)c2c1C,C12568954_decoy,WEE1,Decoy,0.0,-10.1974,-8.04,-1.96,-7.919533030568773
Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1,C25258314_decoy,WEE1,Decoy,0.0,-10.2583,-10.13,-1.31,-17.532235766765556
O=C(NC(=S)Nc1ccc(N2CCN(C(=O)C(F)(F)F)CC2)cc1)c1cc2ccccc2o1,C30828785_decoy,WEE1,Decoy,0.0,-8.09409,-0.96,-1.51,-3.5174312520463515
O=C(COc1ccc(Br)cc1Br)NC(=O)Nc1ccc2c(c1)OCO2,C32169451_decoy,WEE1,Decoy,0.0,-8.02093,-9.02,-1.24,-7.799197666680317
COc1ccccc1C(=O)N1CCC(C(=O)N[C@H]2CCCC[C@H]2NC(=O)c2ccccc2C)CC1,C34899773_decoy,WEE1,Decoy,0.0,-7.98728,-6.77,-1.49,-5.9847238800201215
COc1ccc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)[C@H]2CCCN(C(=O)c3ccc(C)cc3)C2)cc1,C34899998_decoy,WEE1,Decoy,0.0,-8.3468,-10.7,-2.23,-8.830404141057304
O[C@@H]1[C@H](Oc2ccc(Br)cc2Br)O[C@@H]2CO[C@H](c3ccco3)O[C@H]2[C@@H]1O,C35270152_decoy,WEE1,Decoy,0.0,-7.17784,-5.82,-1.47,-5.134869981162378
Cc1nc(-c2ccc(F)cc2)c(CC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCN3)c2)s1,C12569607_decoy,WEE1,Decoy,0.0,-9.46626,-8.58,-2.34,-11.48792365887364
NN1[C@@H](SCC(=O)c2ccc(Br)cc2)N=N[C@H]1[C@@H]1C=C(c2ccc(F)cc2)N=N1,C38556316_decoy,WEE1,Decoy,0.0,-9.37096,-9.2,-1.36,-9.398078026569738
CSc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H]4COc5ccccc5O4)ccc32)cc1,C38700682_decoy,WEE1,Decoy,0.0,-9.83246,-10.78,-1.1,-8.774872052465696
CSc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H]4COc5ccccc5O4)ccc32)cc1,C38700686_decoy,WEE1,Decoy,0.0,-10.7487,-11.1,-0.92,-8.258469697291668
Cc1cccc(OCC(=O)Nc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@@H](C)C3)c1,C39836247_decoy,WEE1,Decoy,0.0,-10.1609,-8.89,-0.33,-9.134446123770642
O=C(Cc1ccccc1)NNC(=O)c1ccc(-n2nc(C(F)(F)F)c3c2-c2ccoc2CC3)cc1,C39852186_decoy,WEE1,Decoy,0.0,-7.62576,-10.17,-1.09,-7.849750841496931
CCOC(=O)C1=CN(C2CC2)c2c(cc(N)c(N3CCC4=C(C3)/C(=N\OC)[C@H](C)CS4)c2C)C1,C49036209_decoy,WEE1,Decoy,0.0,-8.9852,-8.55,-1.96,-7.443753194598448
Cc1cc(NC(=O)c2nn3c(c2Cl)N[C@H](c2ccc(Br)cc2)C[C@H]3C(F)(F)F)no1,C01215191_decoy,WEE1,Decoy,0.0,-9.0075,-6.15,-0.78,-6.07982000133733
CC(=O)NCc1ccc(-c2csc(NC(=O)c3nn(-c4ccc(C)cc4)c4c3CCC4)n2)cc1,C29778095_decoy,WEE1,Decoy,0.0,-9.89366,-9.36,-2.48,-7.835192477075232
O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1,C14066034_decoy,WEE1,Decoy,0.0,-8.38481,-11.27,-1.4,-8.486425325764525
O=C1N=C2NC3=C(C(=O)C[C@@H](c4ccco4)C3)[C@@H](c3ccc(F)c(Br)c3)[C@H]2C(=O)N1,C63637695_decoy,WEE1,Decoy,0.0,-8.18593,-5.0,-1.33,-4.245068100199036
Cc1ccsc1CCNC(=O)c1ccc2c(=O)nc3n(c2c1)C(=S)S[C@H]3C(=O)NC(C)C,C63704999_decoy,WEE1,Decoy,0.0,-10.297,-9.49,-1.6,-9.64734130366186
CC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3[C@H]2CC(=O)NC2CCCCC2)cc1,C35559487_decoy,WEE1,Decoy,0.0,-9.17201,-7.61,-1.41,-7.73112016353801
Nc1nc(F)c(F)c(Oc2ccccc2Oc2c(F)c(N)nc(F)c2F)c1F,C02203885_decoy,WEE1,Decoy,0.0,-8.37325,-9.4,-0.09,-9.703353405363115
CCOC(=O)c1ccc(-c2ccc([C@H]3C(C#N)=C(N)Oc4cc(N)ccc43)o2)cc1,C08846199_decoy,WEE1,Decoy,0.0,-8.50788,-6.01,-1.0,-5.074153762070084
Cc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1NC(=O)c1ccco1,C09670244_decoy,WEE1,Decoy,0.0,-9.38843,-8.83,-0.94,-8.242183339871534
COc1ccc([C@@H]2c3c(O)n[nH]c3C[C@](C)(O)[C@@H]2C(=O)Nc2ccccc2C)cc1,C15080955_decoy,WEE1,Decoy,0.0,-9.61511,-4.82,-2.31,-5.508116440858278
CC(C)c1ccc(NC2=N[C@H]3[C@@H](O)[C@H](O)C[C@H](C(=O)NC4CCCC4)[C@H]3S2)cc1,C15675417_decoy,WEE1,Decoy,0.0,-10.2728,-9.01,-0.72,-7.96197010868932
CCOC(=O)c1c(C)[nH]c(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c1C,C19328047_decoy,WEE1,Decoy,0.0,-9.7134,-7.18,-0.6,-10.322265739633131
COc1cc(C2C(C#N)=C(N)SC(N)=C2C#N)ccc1OCc1ccc(Cl)c(Cl)c1,C00664544_decoy,WEE1,Decoy,0.0,-9.59896,-10.05,-2.25,-9.754703831650152
CN1CCc2nc3sc(C(=O)c4sc5nc6c(cc5c4N)CN(C)CC6)c(N)c3cc2C1,C20528878_decoy,WEE1,Decoy,0.0,-9.88553,-6.27,-0.49,-5.346675433866294
CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2,C20682281_decoy,WEE1,Decoy,0.0,-9.45556,-8.52,-3.68,-8.768641528135898
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)c2c[nH]nc2-c2ccc(F)cc2)cc1,C21208709_decoy,WEE1,Decoy,0.0,-8.26113,-9.23,-1.89,-10.750238854177685
Nn1c(NN=C2CCCC2)nnc1SCC(=O)Nc1ccc(Cl)cc1Cl,C21327869_decoy,WEE1,Decoy,0.0,-10.177,-7.89,-1.3,-12.016882781561032
NS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCCC3)c1,C23394009_decoy,WEE1,Decoy,0.0,-10.7732,-10.05,-1.43,-9.906060768020083
Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)Nc1cc(C(N)=O)ccc1N1CCCC1,C25069597_decoy,WEE1,Decoy,0.0,-9.28724,-9.84,-1.85,-9.65216026489065
CCN(CC)c1nc(N)c2c(N)nc3c(c2c1C#N)CC(=O)N3c1ccc(C)cc1,C25247279_decoy,WEE1,Decoy,0.0,-8.74181,-9.78,0.04,-13.373964345361356
CC(C)[C@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2,C25336415_decoy,WEE1,Decoy,0.0,-7.96746,-5.19,-2.4,-5.637570538284866
Cc1cc(SCC(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)c(C)cc1Br,C30983560_decoy,WEE1,Decoy,0.0,-9.49077,-7.38,-0.57,-8.284758615375534
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3sc4c(c3C(N)=O)CCCC4)C2=O)cc1,C31632231_decoy,WEE1,Decoy,0.0,-8.17848,-6.22,-1.05,-4.804260543792266
CCNC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)C1,C33310230_decoy,WEE1,Decoy,0.0,-7.72572,-8.9,-1.93,-8.926505593551365
Cc1ccc(Nc2nc(C(=O)NCc3ccc(S(N)(=O)=O)cc3)cs2)c(C)c1,C35596818_decoy,WEE1,Decoy,0.0,-9.02891,-10.03,-0.91,-12.672803213764205
Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)c1C,C02889368_decoy,WEE1,Decoy,0.0,-7.80691,-8.15,-2.87,-7.4400888742008355
NN1[C@@H](SCC(=O)c2ccccc2Br)NN[C@@H]1[C@H]1C=C(c2ccccc2)N=N1,C38556197_decoy,WEE1,Decoy,0.0,-7.61457,-8.17,-2.88,-6.806961725638744
NN1[C@@H](SCC(=O)c2ccccc2Br)NN[C@@H]1[C@@H]1C=C(c2ccccc2)N=N1,C38556198_decoy,WEE1,Decoy,0.0,-8.25777,-9.81,-2.32,-10.14382803330538
Cc1ccc(C(=O)CS[C@H]2NN[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)cc1,C38748420_decoy,WEE1,Decoy,0.0,-8.26416,-5.89,-1.51,-5.317967335027947
NN1[C@@H](SCc2cccc3ccccc23)NN[C@@H]1[C@H]1C=C(c2ccccc2)N=N1,C38994919_decoy,WEE1,Decoy,0.0,-6.93417,-6.36,-2.33,-4.248891010158461
CS[C@H]1Nc2ccc(NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(C)=O)cc2S1,C39440542_decoy,WEE1,Decoy,0.0,-9.50153,-6.67,-1.95,-7.020183475854378
O=C(CSc1ccc(Br)cc1)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1,C39558608_decoy,WEE1,Decoy,0.0,-7.80732,-8.93,-1.46,-8.680295955527294
Cc1ccc(NC(=O)[C@H]2CC(=O)Nc3nc(Nc4ccc(F)cc4)[nH]c(=O)c32)cc1,C40399605_decoy,WEE1,Decoy,0.0,-6.61147,-7.62,-2.09,-5.890426515039475
Cc1cc(C)cc(NC(=O)[C@H]2CC(=O)Nc3nc(Nc4ccc(F)cc4)[nH]c(=O)c32)c1,C40399621_decoy,WEE1,Decoy,0.0,-7.89645,-7.14,-1.36,-5.971054924852644
C[C@H]1CCc2c(sc(NC(=O)[C@]3(C)Sc4ccccc4NC3=O)c2C(N)=O)C1,C41644352_decoy,WEE1,Decoy,0.0,-9.23931,-6.66,-0.16,-5.245815758870256
CC(C)[C@H](NC(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccc2c(c1)OCCO2,C09791384_decoy,WEE1,Decoy,0.0,-9.19074,-8.5,-3.38,-9.977764833533818
CC(C)NC(=O)C[C@@H]1c2nc(Nc3cccnc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553704_decoy,WEE1,Decoy,0.0,-9.11901,-8.55,-1.3,-10.000545659734046
Cc1n[nH]c(O)c1[C@H](c1ccc(-c2ccc(Br)cc2)o1)c1c(O)n[nH]c1C,C20139441_decoy,WEE1,Decoy,0.0,-8.41119,-9.31,-0.62,-8.890756163856897
Cc1ccc2c(c1C)NC(=O)[C@]21N[C@H](CC(N)=O)[C@H]2C(=O)N(Cc3ccc(F)cc3)C(=O)[C@H]21,C16013194_decoy,WEE1,Decoy,0.0,-8.16841,-5.73,-2.03,-4.785394318782461
O=C1Nc2cc3[nH]c(=O)[nH]c3cc2N/C1=C/C(=O)c1ccc(C2CCCCC2)cc1,C13284054_decoy,WEE1,Decoy,0.0,-7.0889,-8.84,-3.74,-5.487132271978063
C[C@H](NC(=O)c1cc2ccc(Br)cc2[nH]1)c1ccc2[nH]c(=O)[nH]c2c1,C53853446_decoy,WEE1,Decoy,0.0,-8.31772,-9.6,-1.23,-7.688947781899497
C[C@@H](NC(=O)c1cc2ccc(Br)cc2[nH]1)c1ccc2[nH]c(=O)[nH]c2c1,C53853448_decoy,WEE1,Decoy,0.0,-8.37987,-9.48,-1.07,-12.83100153550577
NS(=O)(=O)c1ccc(N[C@@H](c2cccs2)c2ccc3cccnc3c2O)cc1,C54621216_decoy,WEE1,Decoy,0.0,-9.21883,-5.43,-3.07,-5.156950437515294
CCC(=O)Nc1ccc([C@@H](C)NC(=O)NC2[C@@H]3CCC[C@H]2C[NH+](C2CC2)C3)cc1,C56807135_decoy,WEE1,Decoy,0.0,-7.53676,-7.5,-2.87,-4.20223369218183
C[C@@H](NCC(=O)Nc1sc2c(c1C#N)CCCCC2)c1ccc(S(N)(=O)=O)cc1,C57355146_decoy,WEE1,Decoy,0.0,-9.60105,-8.86,-0.93,-9.626553893762337
C[C@@H](CO)NC(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F,C57888136_decoy,WEE1,Decoy,0.0,-6.6183,-8.52,-3.78,-6.092475604096036
CC(C)c1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3sc4c(c3C(N)=O)CCCC4)C2=O)cc1,C31749178_decoy,WEE1,Decoy,0.0,-10.7154,-8.98,-3.98,-9.662471434934629
Cc1sc2nc([C@H](C)Sc3nnc(COc4ccc(F)cc4)n3N)nc(N)c2c1C,C58551191_decoy,WEE1,Decoy,0.0,-8.454,-9.29,-2.2,-8.108550495829448
CC(C)(C)c1ccc2cc(C(=O)NNC(=O)c3cc(Br)c[nH]3)[nH]c2c1,C29063180_decoy,WEE1,Decoy,0.0,-7.16915,-9.42,-1.1,-7.531832412027946
C[C@H](NC(=O)Nc1ccccc1Oc1ccccc1)c1ccc(S(N)(=O)=O)cc1,C43349635_decoy,WEE1,Decoy,0.0,-7.52712,-9.4,-1.41,-8.145111264978427
C[C@H](NC(=O)Nc1ccccc1SC(F)F)c1ccc(S(N)(=O)=O)cc1,C43552709_decoy,WEE1,Decoy,0.0,-8.28413,-8.42,-1.58,-9.04343639576719
Cc1nn(-c2ccccc2)c2c1[C@@H](c1cccc(OCc3ccccc3)c1)C(C(N)=O)=C(N)O2,C58903563_decoy,WEE1,Decoy,0.0,-7.78782,-8.58,-1.07,-10.291817193785596
Cc1sc(/N=C/c2ccc(/C=N/c3sc(C)c(C)c3C(N)=O)cc2)c(C(N)=O)c1C,C59466901_decoy,WEE1,Decoy,0.0,-10.0245,-7.12,-1.2,-10.767108228488375
NS(=O)(=O)c1cc2c(cc1Cl)N[C@H](c1ccc(OC(F)(F)F)cc1)NS2(=O)=O,C59590114_decoy,WEE1,Decoy,0.0,-9.1345,-8.89,-0.97,-13.5780901846104
Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccc(Cl)cc1,C08659243_decoy,WEE1,Decoy,0.0,-8.90986,-8.92,-2.06,-9.9242222006397
N/C(=N/C(=O)c1ccccc1NC(=O)c1ccccc1)Nc1nc2ccccc2o1,C13110642_decoy,WEE1,Decoy,0.0,-7.73708,-9.91,-1.1,-8.978005864033774
C[C@H]1CCc2c(sc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3Cl)c2C(N)=O)C1,C01114395_decoy,WEE1,Decoy,0.0,-9.45074,-8.51,-0.45,-8.723679499909236
CCOC(=O)[C@H]1[C@@H](c2cccc3ccccc23)NC(=S)N[C@]1(O)C(F)(F)F,C04269869_decoy,WEE1,Decoy,0.0,-5.72891,-4.69,-1.85,-3.871586504369412
Cc1ccc(C(=O)Nc2c(C(N)=O)sc3nc(C(F)F)cc(C4CC4)c23)cc1,C02791081_decoy,WEE1,Decoy,0.0,-9.09184,-9.66,-0.77,-9.336796604686905
COc1c(C)cc(Br)cc1C(=O)NC(=S)Nc1cc(C)c(C)cc1O,C02891196_decoy,WEE1,Decoy,0.0,-7.30166,-8.76,-2.61,-7.4442573169484545
Cc1ccc(S(=O)(=O)NNC(=S)Nc2ccc(Br)cc2)cc1,C06613772_decoy,WEE1,Decoy,0.0,-9.59077,-9.02,-3.01,-8.681457931168357
Cc1ccc(NCC(=O)N/N=C/c2cc(I)cc(C)c2O)cc1,C09934815_decoy,WEE1,Decoy,0.0,-8.26446,-6.91,-0.63,-5.954837266749636
NC(=O)c1c(NC(=O)CSc2nc3cc(Cl)ccc3s2)sc2c1CCCC2,C12700954_decoy,WEE1,Decoy,0.0,-10.9028,-9.19,-1.32,-11.7869540609771
CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1)N2,C13637999_decoy,WEE1,Decoy,0.0,-9.68206,-9.3,-1.6,-8.66637468361829
C/C(=C\Cc1c(O)cc(C)c(C=O)c1O)[C@H](O)C[C@@]1(C)[C@H](C)CCC(=O)[C@H]1C,C14957882_decoy,WEE1,Decoy,0.0,-8.7877,-8.74,-3.5,-9.707028315883278
COC(=O)CC[C@H](C)[C@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@@H]3C[C@H](O)[C@@]21C,C15449191_decoy,WEE1,Decoy,0.0,-9.88888,-4.92,-4.2,-3.583872961414976
Cc1ccc(C(=O)NC(=S)Nc2ccc(C(=O)NC3CCCCC3)cc2)cc1,C20058658_decoy,WEE1,Decoy,0.0,-8.71735,-8.04,-2.28,-7.102018994326116
CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1)N2,C20680228_decoy,WEE1,Decoy,0.0,-7.90378,-9.29,-0.81,-7.3796251885368065
CCN(CC)c1ccc([C@@H]2Nc3ccc(S(N)(=O)=O)cc3[C@@H]3C=CC[C@H]32)cc1,C20696775_decoy,WEE1,Decoy,0.0,-9.17275,-8.73,-2.6,-7.280599172550935
Cc1ccc(CNC(=O)CSc2nc(N)c3c4c(sc3n2)CCCC4)cc1,C03551262_decoy,WEE1,Decoy,0.0,-8.72068,-9.27,-0.96,-8.308580677651515
Cc1ccc(S[C@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1C,C23767207_decoy,WEE1,Decoy,0.0,-8.58244,-8.66,-1.26,-9.560255115634355
C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NNc2c(F)c(F)c(F)c(F)c2F)cc1,C31554389_decoy,WEE1,Decoy,0.0,-6.74173,-9.74,-0.64,-6.975509154048306
O=C(NNC(=S)N[C@H]1C[C@H](c2ccccc2)Oc2ccccc21)c1ccccc1,C06575758_decoy,WEE1,Decoy,0.0,-8.81598,-9.11,-5.12,-8.149487948445866
COc1ccc(C(=O)[C@H]2[C@@H](c3ccc(F)cc3)NC(=S)N[C@]2(O)C(F)(F)F)cc1,C35023254_decoy,WEE1,Decoy,0.0,-7.56762,-5.08,-3.02,-4.532508369884876
CSc1ccc([C@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2ccc(Cl)cc2)cc1,C35980668_decoy,WEE1,Decoy,0.0,-9.18124,-5.29,-2.3,-5.1448421396164585
FC(F)Oc1ccc(NC(=S)N/N=c2\cc[nH]c3cc(Cl)ccc23)cc1,C13684354_decoy,WEE1,Decoy,0.0,-8.96604,-7.9,-0.15,-7.553822493514638
C[C@H](Sc1nnc(N)s1)C(=O)Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F,C39426537_decoy,WEE1,Decoy,0.0,-7.00227,-8.83,-0.96,-6.756996659949068
NC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2ccc(C3SCCS3)cc2)c1,C39549111_decoy,WEE1,Decoy,0.0,-11.1382,-10.18,-1.36,-10.899314471592954
CC(C)NC(=O)Nc1cccc(C(=O)N[C@@H](C)c2cccc(Br)c2)c1,C30839898_decoy,WEE1,Decoy,0.0,-9.2635,-9.59,-1.99,-10.35856712588913
C[C@@H](NC(=O)Nc1ccccc1F)C(=O)Nc1ccccc1Cc1ccccc1,C40356169_decoy,WEE1,Decoy,0.0,-8.04937,-8.96,-1.14,-13.381594599167835
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1sc2c(c1C(N)=O)CCC2,C40946590_decoy,WEE1,Decoy,0.0,-8.21763,-7.9,-1.27,-10.724250521762032
C[C@H](NC(=O)NNC(=O)c1ccc(F)cc1)C(c1ccccc1)c1ccccc1,C47049961_decoy,WEE1,Decoy,0.0,-7.56822,-8.74,-0.89,-8.409746649040258
C=CCNC(=O)c1ccc(NC(=O)NCc2cc(Br)cs2)cc1,C48160987_decoy,WEE1,Decoy,0.0,-7.93225,-6.92,-2.32,-7.736984197104454
CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccccc1I,C49458987_decoy,WEE1,Decoy,0.0,-7.64665,-5.11,-2.38,-4.515802682271798
CC[C@@H]1C(C#N)=C(S[C@@H](C(N)=O)c2ccccc2)NC2=C1C(=O)CC(C)(C)C2,C02275208_decoy,WEE1,Decoy,0.0,-9.80376,-9.18,-0.86,-8.723094492825744
Cc1ccc([C@H](C)NC(=O)Nc2cc(C(=O)NCC(F)(F)F)ccc2C)s1,C54430854_decoy,WEE1,Decoy,0.0,-6.93444,-8.11,-1.78,-6.966934608914577
C[C@H](NC(=O)NCc1cccs1)c1ccc(NC(=O)c2ccc(F)cc2)cc1,C55339666_decoy,WEE1,Decoy,0.0,-8.9922,-7.32,-4.18,-6.827396855459888
N/C(=N\OCC(=O)Nc1cccc(I)c1)C1CCCC1,C47272658_decoy,WEE1,Decoy,0.0,-7.60149,-7.93,-1.78,-7.683016235013738
CN(C)c1ccc([C@@H]2NC(=S)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccccc2)cc1,C57531382_decoy,WEE1,Decoy,0.0,-7.38935,-4.39,-1.19,-4.845567808985832
C[C@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1cccc(S(N)(=O)=O)c1,C57898302_decoy,WEE1,Decoy,0.0,-9.13469,-8.15,-1.37,-8.205940123427677
CC(C)Cn1ccc2cc(NC(=O)NC[C@@H](O)c3ccc(F)c(F)c3)ccc21,C58326913_decoy,WEE1,Decoy,0.0,-8.36473,-8.89,-3.63,-7.352544626121106
Cc1cc(C)c(NC(=O)CNC(=O)N[C@@H](C)c2cccc(Br)c2)c(C)c1,C58715811_decoy,WEE1,Decoy,0.0,-7.98192,-9.12,-3.39,-7.430784265686992
CC[NH+](CC)c1ccc([C@@H]2NC(=O)c3sc(=S)n(-c4ccccc4)c3N2)cc1,C06418097_decoy,WEE1,Decoy,0.0,-10.808,-4.99,-0.25,-6.002194011112538
Cc1cc(C)c(NC(=O)CNc2ccc(C(=O)NC3CCCC3)cc2C)c(C)c1,C65277339_decoy,WEE1,Decoy,0.0,-8.45422,-8.89,-2.28,-7.704814966415681
C[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1,C66066905_decoy,WEE1,Decoy,0.0,-9.20593,-8.74,-5.26,-6.888794287748564
C[C@H](NC(=S)NNC(=O)c1ccc(Cl)o1)c1ccc(Cl)cc1Cl,C66122349_decoy,WEE1,Decoy,0.0,-8.87827,-8.14,-1.9,-9.85592188559164
CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H]1CSc2ccccc2O1,C66123496_decoy,WEE1,Decoy,0.0,-7.86275,-8.59,-1.88,-7.968723548781065
O=C(Nc1ccccc1)c1cccc(NC(=S)NC(=O)c2ccccc2F)c1,C66197965_decoy,WEE1,Decoy,0.0,-9.63923,-7.83,-3.69,-9.779027815211736
O=C(NC[C@@H]1CCN(c2ccc(F)cc2)C1)NC[C@@H](O)c1ccc(Cl)cc1,C66344426_decoy,WEE1,Decoy,0.0,-8.59471,-9.44,-2.93,-8.97086768682318
CC(=O)Nc1ccc(NC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1,C66346537_decoy,WEE1,Decoy,0.0,-8.7858,-4.67,-2.15,-5.745785401561087
C[C@@H](NC(=O)NNC(=O)Cc1ccccc1F)c1ccc(Br)cc1,C66907955_decoy,WEE1,Decoy,0.0,-7.0593,-9.13,-1.28,-8.638771079575326
O=C(CC1CCCCC1)NNC(=O)NCc1cc(F)ccc1Br,C67061339_decoy,WEE1,Decoy,0.0,-7.73608,-6.41,-3.68,-4.287374929873439
O=C(CCC1CCCCC1)NNC(=O)NCc1sccc1Br,C67067117_decoy,WEE1,Decoy,0.0,-8.76849,-7.82,-1.02,-8.139091045039534
CNC(=O)c1ccc(NC(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)cc1,C67254966_decoy,WEE1,Decoy,0.0,-8.50877,-9.17,-2.87,-8.072183888266926
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1,C67337745_decoy,WEE1,Decoy,0.0,-7.07149,-9.02,-4.07,-6.753738656068559
CN(Cc1cccc(C(N)=O)c1)C(=O)N[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1,C67568793_decoy,WEE1,Decoy,0.0,-7.17958,-8.36,-2.03,-6.311345025681595
O=C(Nc1cccc2ccccc12)c1ccccc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-],C00627372_decoy,WEE1,Decoy,0.0,-7.58024,-11.49,-1.95,-10.049718860561676
O=C([O-])c1cccc(NC(=O)c2c(NC(=O)c3ccccc3)sc3c2CCCC3)c1,C01933535_decoy,WEE1,Decoy,0.0,-8.37652,-9.85,-3.86,-9.409208611095098
O=C([O-])c1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1,C13059450_decoy,WEE1,Decoy,0.0,-9.82437,-11.33,-2.1,-8.878406065414794
Cc1cc(C(=O)[O-])cc(S(=O)(=O)NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1C,C13078648_decoy,WEE1,Decoy,0.0,-8.31591,-10.57,-1.67,-8.717687700729204
O=C(NNS(=O)(=O)c1ccc(F)c(C(=O)[O-])c1)c1ccc(-c2ccc(F)cc2)s1,C13079358_decoy,WEE1,Decoy,0.0,-8.21288,-9.73,-1.67,-7.656500360518326
O=C(Nc1ccc(Br)cc1C(=O)[O-])c1cccc(S(=O)(=O)NC2CC2)c1,C13260397_decoy,WEE1,Decoy,0.0,-10.0897,-8.77,-0.75,-9.078038957367225
COc1ccc(C(=O)[O-])cc1S(=O)(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2,C13361287_decoy,WEE1,Decoy,0.0,-8.72371,-8.68,-1.16,-7.612852943103652
Cc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1C(=O)[O-],C13361301_decoy,WEE1,Decoy,0.0,-8.29517,-10.45,-4.23,-8.7537679987875
C/C(=N\N=C1/NC(=O)C[C@@H](C(=O)Nc2ccc(C(=O)[O-])cc2)S1)c1ccc(C)cc1,C13941996_decoy,WEE1,Decoy,0.0,-8.41937,-7.61,-2.0,-6.698326978480248
O=C([O-])c1cccc([C@@H]2Nc3ccc(S(=O)(=O)Nc4ncccn4)cc3[C@@H]3C=CC[C@H]32)c1,C14944234_decoy,WEE1,Decoy,0.0,-10.0357,-11.45,-2.78,-12.118285747076696
O=C([O-])c1cccc([C@H]2Nc3ccc(S(=O)(=O)Nc4ncccn4)cc3[C@@H]3C=CC[C@@H]23)c1,C14944236_decoy,WEE1,Decoy,0.0,-8.89328,-8.16,-1.95,-7.767331262301958
O=C(NC(=S)Nc1ccc(Cl)cc1C(=O)[O-])c1ccc([N+](=O)[O-])cc1Cl,C16385782_decoy,WEE1,Decoy,0.0,-8.38398,-9.49,-0.49,-9.227979161397124
O=C(Nc1ccccc1F)c1ccsc1NC(=O)[C@@H]1[C@H](C(=O)[O-])[C@H]2C=C[C@@H]1C2,C17081835_decoy,WEE1,Decoy,0.0,-7.22038,-9.95,-2.41,-9.247797204339712
CC1=C(C)C[C@@H](C(=O)Nc2sc3c(c2C(=O)NC2CC2)CCC3)[C@@H](C(=O)[O-])C1,C17082478_decoy,WEE1,Decoy,0.0,-9.80196,-9.17,-1.27,-10.079379953931888
Cc1sc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])c(C(=O)NC2CCCCC2)c1C,C17082916_decoy,WEE1,Decoy,0.0,-8.46273,-9.83,-0.96,-9.07193342648238
CC(C)(C)[C@@H]1CCc2c(C(=O)NNC(=O)[C@@H]3CCCC[C@@H]3C(=O)[O-])csc2C1,C17087449_decoy,WEE1,Decoy,0.0,-8.8176,-7.43,-1.35,-8.088025605181645
CC(C)c1cc(C(=O)Nc2ccccc2)c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])s1,C17089209_decoy,WEE1,Decoy,0.0,-7.68065,-8.53,-3.93,-11.505125157882317
CC(C)c1cc(C(=O)Nc2ccccc2)c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])s1,C17089212_decoy,WEE1,Decoy,0.0,-8.16731,-9.0,-3.4,-9.157594512340284
Cc1cccc(NC(=O)c2c(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])sc3c2CCC3)c1,C17094003_decoy,WEE1,Decoy,0.0,-10.4197,-6.46,-1.74,-5.921846023964506
CC(C)c1cc(C(=O)Nc2ccccc2)c(NC(=O)[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C(=O)[O-])s1,C17094938_decoy,WEE1,Decoy,0.0,-7.66339,-7.82,-3.4,-7.705539870372739
Cc1ccc(-c2csc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)[O-])c2C(=O)NC2CC2)cc1,C17094941_decoy,WEE1,Decoy,0.0,-8.76305,-9.37,-4.23,-8.948740115336852
Cc1ccccc1NC(=O)c1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])sc2c1CCC2,C17094979_decoy,WEE1,Decoy,0.0,-8.6894,-6.84,-2.18,-8.177419091616342
CC1=C(C)C[C@@H](C(=O)Nc2sc(C)c(C)c2C(=O)NC2CCCCC2)[C@@H](C(=O)[O-])C1,C17098090_decoy,WEE1,Decoy,0.0,-8.18697,-5.03,-2.52,-5.21487246321718
Cc1ccc(CNC(=O)c2c(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])sc3c2CCC3)cc1,C17102482_decoy,WEE1,Decoy,0.0,-8.45851,-9.48,-1.47,-8.749338978967977
COc1ccccc1NC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])sc2c1CCC2,C19631798_decoy,WEE1,Decoy,0.0,-9.73314,-8.44,-1.49,-10.118193489007904
COc1ccccc1NC(=O)c1c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])sc2c1CCC2,C19631801_decoy,WEE1,Decoy,0.0,-10.5526,-8.82,-3.17,-10.005010283160132
C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)[O-])c2C(=O)NCc2ccco2)C1,C19641226_decoy,WEE1,Decoy,0.0,-10.3309,-8.75,-2.77,-10.261479501461144
O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])cc1,C20116205_decoy,WEE1,Decoy,0.0,-7.30364,-9.41,-2.63,-7.1610261743737205
Nc1ncc(Br)cc1S(=O)(=O)[N-]c1ccc(OC(F)(F)F)cc1,C20467674_decoy,WEE1,Decoy,0.0,-7.38966,-7.71,-2.59,-6.756983672349386
O=C([O-])c1ccccc1C(=O)NNC(=O)[C@H]1CC1(c1ccccc1)c1ccccc1,C22017769_decoy,WEE1,Decoy,0.0,-6.33589,-6.01,-2.7,-4.858358300565628
NS(=O)(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2Oc2ccccc2)c1,C22410264_decoy,WEE1,Decoy,0.0,-9.55904,-7.9,-0.51,-8.325871935191797
O=C(NC1CCCCC1)c1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])sc2c1CCC2,C17091526_decoy,WEE1,Decoy,0.0,-9.11896,-8.3,-1.7,-9.88728984523464
C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])c2C(=O)NC2CCCCC2)C1,C19641783_decoy,WEE1,Decoy,0.0,-9.9496,-9.58,-5.7,-7.187862230978609
CC(=O)Nc1ccc(NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2)cc1C,C29816941_decoy,WEE1,Decoy,0.0,-10.1843,-9.79,-6.1,-9.135749266312605
Cc1cc(C(=O)N/N=C/c2cc(Br)cc(Br)c2[O-])[nH]n1,C18240539_decoy,WEE1,Decoy,0.0,-7.99087,-8.14,-0.68,-7.09187491035218
N#C/C(=C\c1ccc(-c2ccc(S([NH-])(=O)=O)cc2)o1)c1nc(O)c2ccccc2n1,C34990083_decoy,WEE1,Decoy,0.0,-8.72711,-9.58,-0.68,-12.719310105398566
O=C(NC1CCCCC1)c1c(NC(=O)[C@@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C(=O)[O-])sc2c1CCCC2,C35897646_decoy,WEE1,Decoy,0.0,-9.78047,-4.76,-1.23,-5.910923266901024
Cc1cc(C)cc(NC(=O)Nc2ccc(S(=O)(=O)[N-]c3cc(C)on3)cc2)c1,C01027679_decoy,WEE1,Decoy,0.0,-8.19706,-8.99,-2.48,-6.937110958337575
O=C(Nc1[nH+]cccc1[O-])c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1,C36619904_decoy,WEE1,Decoy,0.0,-8.36663,-9.93,-3.98,-9.06266156416847
CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(C(=O)[O-])cc2)N2NC=C(C#N)C2=N1,C13569315_decoy,WEE1,Decoy,0.0,-8.01028,-6.05,-1.87,-4.494857595112906
Cc1ccc(Sc2ccc([N-]S(=O)(=O)c3cc(C(N)=O)n(C)c3)cc2)c(C)c1,C28198341_decoy,WEE1,Decoy,0.0,-9.10197,-9.8,-2.09,-8.596970895289031
Cc1cc(NC(=O)c2cccc([N-]S(=O)(=O)c3ccc(Br)cc3)c2)[nH]n1,C59025646_decoy,WEE1,Decoy,0.0,-8.30125,-5.64,-1.42,-4.97959882809183
O=C1N=C([O-])/C(=C\c2cc(I)c(O)cc2O)C(=O)N1c1ccc(F)cc1,C59106218_decoy,WEE1,Decoy,0.0,-8.62749,-9.67,0.24,-8.080391159086792
O=C(Nc1ccc(F)cc1)[C@H]1CC([O-])=N/C(=N\c2ccc(Oc3ccccc3)cc2)N1,C02339597_decoy,WEE1,Decoy,0.0,-7.44214,-10.07,-2.66,-7.397713867992046
C[C@@H](NC(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)c1ccccc1[N-]S(C)(=O)=O,C59849935_decoy,WEE1,Decoy,0.0,-8.47887,-7.85,-1.33,-7.505815135976308
Cc1nc(NC(=O)Nc2ccc(I)cc2C(=O)[O-])sc1C,C62824802_decoy,WEE1,Decoy,0.0,-8.1871,-8.21,-1.69,-7.49707768766928
COC[C@H](C)NC(=O)Nc1c(Br)cc(Br)cc1C(=O)[O-],C62825495_decoy,WEE1,Decoy,0.0,-6.86883,-6.88,-0.22,-7.239319326758908
CC1=C2[C@H](c3ccc(F)c(Br)c3)CC(=O)N[C@H]2N(c2ccc([O-])nn2)N1,C63822305_decoy,WEE1,Decoy,0.0,-8.49718,-8.01,-1.56,-6.4716098941666855
CC1=C2[C@@H](c3cccc(Br)c3)CC(=O)N[C@@H]2N(c2ccc([O-])nn2)N1,C63823474_decoy,WEE1,Decoy,0.0,-5.8628,-5.34,-3.28,-4.144217931948647
CC(C)(C)c1ccc([C@H]2c3sc([S-])nc3S[C@@H]3C(=O)N(C(N)=O)C(=O)[C@H]23)cc1,C39886749_decoy,WEE1,Decoy,0.0,-8.07545,-5.16,-1.76,-4.032086175857115
COc1ccc(N2C(N)=C(C#N)[C@H](c3ccc4c(c3)OCO4)C3=C2CCCC3=O)cc1,C00705515_decoy,WEE1,Decoy,0.0,-6.79408,-5.02,-1.32,-4.237423769624503
CNC(=O)NC(=O)CSc1nnc(-c2cccs2)n1-c1ccc(Cl)cc1,C01035687_decoy,WEE1,Decoy,0.0,-10.9165,-7.62,-2.36,-8.841827600839322
Nc1c(C(=O)OC[C@@H]2CCCO2)c2nc3ccccc3nc2n1-c1ccc(F)cc1,C02235176_decoy,WEE1,Decoy,0.0,-8.69661,-9.5,-0.15,-9.503912982790858
CC(=O)Nc1ccc(NC(=O)CSc2nc3cc4c(cc3cc2C)OCO4)cc1,C00930006_decoy,WEE1,Decoy,0.0,-8.83414,-9.43,-1.85,-8.92680525575839
N#CC1=C(N)N(c2cccc(F)c2)C2=C(C(=O)CCC2)[C@@H]1c1ccc([N+](=O)[O-])s1,C04709680_decoy,WEE1,Decoy,0.0,-5.08563,-4.74,-0.77,-3.280335050894512
O=C(CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O)NC12CC3CC(CC(C3)C1)C2,C05342625_decoy,WEE1,Decoy,0.0,-8.36445,-6.47,-3.35,-4.715194981918859
Nn1c(SCC(=O)c2ccc3c(c2)OCCO3)nnc1-c1ccc(Cl)cc1,C03312834_decoy,WEE1,Decoy,0.0,-9.35615,-9.56,-0.63,-7.630420235919686
Nc1c(S(=O)(=O)c2cccs2)c2nc3ccccc3nc2n1Cc1ccco1,C02411878_decoy,WEE1,Decoy,0.0,-9.03124,-6.78,0.1,-8.135229835066822
Cc1noc(C)c1C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1,C02872517_decoy,WEE1,Decoy,0.0,-8.32919,-7.97,-2.81,-6.739192218249705
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(C(C)C)cc2)C1,C06771089_decoy,WEE1,Decoy,0.0,-8.25038,-7.66,-1.11,-10.373281493662748
C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc2c(c1)OCO2,C08242675_decoy,WEE1,Decoy,0.0,-7.70766,-8.25,-3.3,-7.292697527622666
C[C@H](Oc1ccc(Br)cc1)C(=O)NNC(=O)c1ccc2c(c1)OCO2,C08271826_decoy,WEE1,Decoy,0.0,-7.73007,-8.33,-1.49,-7.427345702174198
O=C(Nc1ccc2c(c1)OCCO2)c1ccccc1NS(=O)(=O)c1cccs1,C03360619_decoy,WEE1,Decoy,0.0,-8.62346,-9.49,-0.95,-8.78473244625743
O=C(Nc1nc(C(=O)Nc2ccc3c(c2)OCCO3)cs1)c1ccc(Cl)cc1,C08873459_decoy,WEE1,Decoy,0.0,-7.87837,-9.51,-0.88,-6.785318853773938
O=C(Nc1ccc(Cl)cc1Cl)N[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1,C10585515_decoy,WEE1,Decoy,0.0,-8.83778,-9.83,-2.05,-7.825673982408389
O=C(Nc1ccc(Cl)cc1Cl)N[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1,C10585519_decoy,WEE1,Decoy,0.0,-9.0485,-9.79,-1.71,-9.61333367783903
CC(C)[C@@H](NC(=O)CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O)c1cccs1,C10840899_decoy,WEE1,Decoy,0.0,-7.67766,-7.31,-1.19,-7.124183455805581
CC(C)[C@@H](NC(=O)c1ccccc1)C(=O)Nc1nc2cc3c(cc2s1)OCCO3,C11751801_decoy,WEE1,Decoy,0.0,-8.67005,-8.8,-1.66,-7.429621228396653
Cc1nc2sc(C(=O)O[C@H](C)C(=O)N[C@H]3CCC[C@H](C)[C@H]3C)c(C)c2c(=O)[nH]1,C12782472_decoy,WEE1,Decoy,0.0,-9.44164,-9.14,-2.18,-8.312079629660163
O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)cc1)[C@@H]1COc2ccccc2C1,C12561014_decoy,WEE1,Decoy,0.0,-9.81307,-7.35,-1.65,-7.333041999032637
CNC(=O)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(C)cc1,C05736328_decoy,WEE1,Decoy,0.0,-7.8273,-8.7,-2.82,-8.451694677212197
CC(=O)N1C[C@@H](C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)Oc2ccccc21,C07738543_decoy,WEE1,Decoy,0.0,-8.38785,-8.97,-2.64,-6.423986830614706
C#CCn1/c(=N/C(=O)c2ccc(C(C)=O)cc2)sc2cc(S(N)(=O)=O)ccc21,C04191355_decoy,WEE1,Decoy,0.0,-8.90706,-4.93,-2.44,-5.484390323738945
C[C@H]1Oc2ccc(NC(=O)c3nn(-c4ccc(F)cc4)c4c3CCCC4)cc2NC1=O,C14781014_decoy,WEE1,Decoy,0.0,-9.02985,-10.36,-3.12,-9.540790305674776
Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(Oc2ccc(F)cc2)cc1,C16181142_decoy,WEE1,Decoy,0.0,-8.08993,-9.4,-2.18,-7.3922632425674974
Cn1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)C(F)(F)F)nn3-c2ccccc2)n1,C02788867_decoy,WEE1,Decoy,0.0,-8.18617,-4.68,-0.65,-5.054568642880495
O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(I)cc1,C03071275_decoy,WEE1,Decoy,0.0,-7.03208,-5.89,-0.77,-5.208531878700396
COc1ccc(NC(=O)C2=C(C)Nc3ncnn3[C@H]2c2ccc(SC)cc2)cc1,C21089785_decoy,WEE1,Decoy,0.0,-9.43549,-7.84,-4.04,-8.165025947350493
C[C@H]1CCc2c(sc3nc(SCC(=O)N(C)[C@@H]4CCS(=O)(=O)C4)nc(N)c23)C1,C22838592_decoy,WEE1,Decoy,0.0,-10.0329,-8.25,-0.06,-8.438182043560287
Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cn2)n1,C32669113_decoy,WEE1,Decoy,0.0,-8.32346,-9.55,-3.9,-7.415109989165164
CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)cc(OC)c3)[C@@H]2C1,C04452908_decoy,WEE1,Decoy,0.0,-7.53231,-4.58,-0.09,-5.018435144530984
CC(C)[C@@H](NC(=O)NC(C)(C)C)C(=O)N1CCN(C(=O)C2CCCCC2)[C@@H](C)C1,C34974956_decoy,WEE1,Decoy,0.0,-7.47425,-4.98,-3.16,-4.158537050893587
CCNC(=O)N1CCC([C@H](NC(=O)c2ccccc2)C(=O)N2CCCC[C@H]2C)CC1,C36213584_decoy,WEE1,Decoy,0.0,-8.47896,-7.95,-3.35,-6.35502245249584
CC(C)(C)NC(=O)N1CCC([C@@H](NC(=O)c2cccs2)C(=O)N2CCCC2)CC1,C36213890_decoy,WEE1,Decoy,0.0,-8.75446,-4.38,-3.82,-5.643318288929122
CC(=O)Nc1ccc(NC(=O)c2cc(-c3cc(C)sc3C)nc3onc(C)c23)cc1C,C36716934_decoy,WEE1,Decoy,0.0,-8.76939,-9.97,-2.37,-8.471336819747322
C#CCOc1c(Br)cc([C@H]2C(C#N)=C(N)O[C@@H]3N=NC(C)=C23)cc1OC,C39287402_decoy,WEE1,Decoy,0.0,-9.39787,-9.04,-1.75,-8.611473961162885
CC(C)Nc1nnc(S[C@H](C)C(=O)N2c3ccccc3NC(=O)C2(C)C)s1,C16979762_decoy,WEE1,Decoy,0.0,-5.20605,-8.88,-0.68,-8.468974542146608
COc1ccc(-c2csc(NC(=O)[C@@]3(C)Oc4ccc(C)cc4NC3=O)n2)cc1,C40805255_decoy,WEE1,Decoy,0.0,-6.08677,-5.98,-1.01,-4.340075355106718
Cc1ccc(N2C[C@H](C(=O)NCC3CCN(C(=O)NC(C)(C)C)CC3)CC2=O)cc1,C43978883_decoy,WEE1,Decoy,0.0,-8.02324,-7.67,-4.41,-7.036564287046441
Cc1nc(NC(=O)[C@H](C)NC(=O)N2CCN(c3ccc(F)cc3)CC2)sc1C,C49544575_decoy,WEE1,Decoy,0.0,-9.02576,-8.23,-4.06,-9.167853199731804
O=C(Nc1ccc(Cl)cn1)c1cnn2c1N[C@H](c1ccco1)C[C@H]2C(F)(F)F,C02884095_decoy,WEE1,Decoy,0.0,-7.63666,-8.23,-4.08,-7.2599957043425505
O=C(CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O)N[C@H](c1ccccc1)C1CC1,C21558505_decoy,WEE1,Decoy,0.0,-7.75394,-5.97,-3.53,-5.154557067987554
CN(C)c1ccc([C@@H]2C3=C(CCCC3=O)Nc3[nH]c(N4CCCCC4)nc(=O)c32)cc1,C19820016_decoy,WEE1,Decoy,0.0,-9.55561,-5.36,-2.05,-5.728831197676805
CC(C)(C)c1ccc(-c2nnc(SCC3=NC(=O)[C@H]4SC=CC4=N3)n2N)cc1,C39779853_decoy,WEE1,Decoy,0.0,-11.1987,-7.14,-1.25,-13.010363283877806
CC(C)(C)c1ccc(-c2nnc(SCC3=NC(=O)[C@@H]4SC=CC4=N3)n2N)cc1,C39779855_decoy,WEE1,Decoy,0.0,-9.53692,-8.83,-0.3,-8.56387409176365
CC(=O)c1cccc(NC(=O)[C@@H]2CC(O)=Nc3c(C)c(-c4ccc(C)cc4)nn32)c1,C35684478_decoy,WEE1,Decoy,0.0,-8.46213,-10.6,-2.55,-8.996300712087379
O=C(Nc1nc2n(n1)[C@@H](c1ccc(F)cc1)C[C@@H](c1ccccc1)N2)c1ccco1,C13121901_decoy,WEE1,Decoy,0.0,-7.81076,-6.34,-1.64,-5.0179248114081325
C[C@H](NC(=O)N1CCN(c2ccc(F)cc2)CC1)C(=O)NC1=C[C@@H]2N=CC=C2C=C1,C64435840_decoy,WEE1,Decoy,0.0,-9.22277,-7.39,-2.28,-6.177961030215537
C[C@H](NC(=O)c1cccc(NC(=O)c2ccco2)c1)C(=O)N1CCCc2ccccc21,C65096623_decoy,WEE1,Decoy,0.0,-7.82658,-8.85,-1.81,-6.317251575955658
CC[C@@H](C)NC(=O)c1cnn2c1N[C@H](c1ccc3c(c1)OCO3)C[C@@H]2C(F)(F)F,C13124143_decoy,WEE1,Decoy,0.0,-7.84857,-5.88,-4.31,-4.888156299444408
N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@@H]1c1cnc2ccccc2n1,C02788758_decoy,WEE1,Decoy,0.0,-7.75063,-5.74,-0.71,-4.439020960724027
Nc1c(S(=O)(=O)c2ccc(Cl)cc2)c2nc3ccccc3nc2n1C[C@H]1CCCO1,C02196000_decoy,WEE1,Decoy,0.0,-9.28224,-8.51,-0.99,-8.86341022810582
NS(=O)(=O)c1cc2c3c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N3C[C@@H]1CC=C[C@H]21,C02955282_decoy,WEE1,Decoy,0.0,-10.8668,-10.02,-1.4,-12.07812547022113
N#CC1=C(N)N(c2ccc([N+](=O)[O-])cc2)C2=C(C(=O)CCC2)[C@@H]1c1ccc(Br)s1,C08809648_decoy,WEE1,Decoy,0.0,-7.65176,-5.18,-0.83,-4.46633258413543
O=C(Nc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccc(Cl)cc1)c1ccc2c(c1)OCO2,C09104301_decoy,WEE1,Decoy,0.0,-9.21632,-9.58,-5.36,-7.986803132913087
CCn1c(SCC(=O)NC(=O)Nc2ccc(C)cc2C)nc2sc(C)c(C)c2c1=O,C09244742_decoy,WEE1,Decoy,0.0,-7.68833,-8.82,-1.22,-7.579269793165624
NS(=O)(=O)c1cc(C(=O)OCc2cc3c(cc2Br)OCO3)ccc1Cl,C09869616_decoy,WEE1,Decoy,0.0,-9.3174,-8.94,-1.49,-10.563069344029604
CC1=C(C(=O)Nc2ccc(Cl)cc2)[C@H](c2ccc(Br)cc2)n2nnnc2N1,C09941960_decoy,WEE1,Decoy,0.0,-8.7094,-9.05,-3.59,-8.328593854022888
O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1F)NC(=O)NC1CCCCC1,C10316680_decoy,WEE1,Decoy,0.0,-8.53188,-8.41,-1.09,-7.800558738961749
O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)c1cc2c(s1)CCCCC2,C10470012_decoy,WEE1,Decoy,0.0,-10.3374,-8.94,-0.37,-8.728715571836961
Cc1sc2nc(SCC(=O)NC(=O)N[C@@H]3CCCC[C@H]3C)n(C(C)C)c(=O)c2c1C,C10876428_decoy,WEE1,Decoy,0.0,-9.25575,-7.76,-3.34,-6.943456894988439
O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccc(S(=O)(=O)N2CCCC2)cc1,C09404921_decoy,WEE1,Decoy,0.0,-8.06388,-10.97,-3.91,-7.423762397735227
Cc1sc2nc(S[C@H](C)C(=O)NC(=O)NC(C)(C)C)n(C3CCCC3)c(=O)c2c1C,C12747267_decoy,WEE1,Decoy,0.0,-7.51774,-6.81,-3.01,-7.0291775922964845
CNS(=O)(=O)c1cc(NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCCC3)ccc1C,C12754936_decoy,WEE1,Decoy,0.0,-8.52913,-6.32,-1.65,-5.098549396101778
COC(=O)[C@H]1[C@@H](c2ccccc2)NC(=S)N(c2ccc3c(c2)OCCO3)[C@@]1(O)C(C)C,C12772318_decoy,WEE1,Decoy,0.0,-6.72604,-5.94,-3.53,-3.97932949117684
Cc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCCO4)cc2)cc1,C13070191_decoy,WEE1,Decoy,0.0,-9.30559,-10.29,-0.08,-13.455932548415966
C[C@@H]1CCc2c(sc3nc(CSc4nnc(-c5ccncc5)n4C4CC4)nc(N)c23)C1,C12533003_decoy,WEE1,Decoy,0.0,-9.35531,-9.66,-0.54,-17.499654840590033
C[C@H]1CCc2c(sc3nc(CSc4nnc(-c5ccncc5)n4C4CC4)nc(N)c23)C1,C12533004_decoy,WEE1,Decoy,0.0,-9.60802,-9.65,-4.0,-7.101339774370311
O=C(CN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(-c2ccc(Br)cc2)o1,C14245555_decoy,WEE1,Decoy,0.0,-8.18989,-9.36,-6.6,-9.72160508480144
Cc1ccc2oc(-c3ccc(NC(=S)NC(=O)c4ccc5c(c4)OCCO5)cc3)nc2c1,C14269388_decoy,WEE1,Decoy,0.0,-10.1393,-10.17,-1.65,-8.014998468688962
CC(=O)Nc1ccc(NC(=O)C2CCN(S(=O)(=O)c3c(C)c(C)cc(C)c3C)CC2)cc1,C15268650_decoy,WEE1,Decoy,0.0,-7.86505,-8.54,-3.99,-6.234074779859917
Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2,C02076778_decoy,WEE1,Decoy,0.0,-8.38826,-7.24,-0.6,-7.619470504553652
Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc4c(c3)OCCO4)cc2)c1,C17304830_decoy,WEE1,Decoy,0.0,-9.05933,-11.27,-1.85,-8.671104710620432
Nn1c(SCc2nnc(-c3ccc(F)cc3)o2)nnc1-c1ccccc1Br,C20830354_decoy,WEE1,Decoy,0.0,-9.69251,-9.37,-1.04,-7.846923709162432
Cc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2)cc1C,C21869360_decoy,WEE1,Decoy,0.0,-8.73267,-9.72,-0.01,-7.238769034668956
O=C([O-])c1ccc(N2CCN(c3cccc[nH+]3)CC2)c(NC(=O)c2ccc(Cl)cc2)c1,C21882287_decoy,WEE1,Decoy,0.0,-9.42372,-11.17,-1.66,-9.499041268499202
Cc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2)c(C)c1,C24976263_decoy,WEE1,Decoy,0.0,-8.91407,-10.88,-2.16,-8.794833981014241
Cc1nc2c(cnn2C(C)C)cc1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1,C27107188_decoy,WEE1,Decoy,0.0,-10.131,-10.2,-2.44,-8.254936299866433
COc1cc(OC)c([C@@H]2[C@@H]3C[C@@H](C(C)(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OC,C16034506_decoy,WEE1,Decoy,0.0,-7.46908,-4.91,-1.66,-4.352175749534344
Cc1ccc(-c2csc(NC(=O)CN3C(=O)N[C@]4(C[C@@H](C)CC(C)(C)C4)C3=O)n2)cc1,C28451119_decoy,WEE1,Decoy,0.0,-8.63156,-6.01,-1.31,-4.682318326175827
C[C@@H](Sc1nc(-c2ccco2)c(C#N)c(=O)[nH]1)C(=O)Nc1ccc(Br)cc1,C31773928_decoy,WEE1,Decoy,0.0,-9.32325,-7.33,-0.79,-8.158157829671756
Cc1ccc(C)c(N2CCN(C(=O)c3ccc([C@H]4Nc5ccccc5S(=O)(=O)N4)cc3)CC2)c1,C33063261_decoy,WEE1,Decoy,0.0,-10.2216,-9.71,-1.99,-7.898194739565582
Cc1ccc(NC(=O)N2CCC[C@@H](c3nnc(C(=O)Nc4ccccc4C)s3)C2)c(C)c1,C33113247_decoy,WEE1,Decoy,0.0,-9.25669,-9.55,-2.35,-10.670523642078772
O=C(Nc1ccc2c(c1)OCCO2)N[C@@H](Cc1ccccc1)C(=O)N1CCc2ccccc21,C33127997_decoy,WEE1,Decoy,0.0,-6.32998,-10.49,-4.33,-7.253427721210474
C[C@H]1CCCCN1C(=O)[C@@H](NC(=O)c1ccccc1)C1CCN(C(=O)NC(C)(C)C)CC1,C36213576_decoy,WEE1,Decoy,0.0,-6.61966,-6.07,-3.5,-6.016190198553418
Cc1ccccc1C(=O)N[C@H](C(=O)N1CCCCC1)C1CCN(C(=O)NC(C)(C)C)CC1,C36213802_decoy,WEE1,Decoy,0.0,-8.19878,-9.08,-3.65,-5.047420083383154
N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccccc1OC(=O)c1cccs1,C03014101_decoy,WEE1,Decoy,0.0,-7.59959,-6.01,-0.59,-5.273856309043925
CSc1nc2ccc(NC(=O)CN3C(=O)N[C@]4(C[C@@H](C)CC(C)(C)C4)C3=O)cc2s1,C09284107_decoy,WEE1,Decoy,0.0,-10.3913,-9.6,-1.04,-11.499155226398653
COc1cc([C@@H]2C(C#N)=C(N)OC3=CC(C)=NC(=O)[C@H]32)ccc1OCc1ccc(Cl)cc1,C39352274_decoy,WEE1,Decoy,0.0,-8.57157,-6.31,-3.47,-5.2049855347355765
COc1cc(/C=N/NC(=O)[C@H]2C=C(c3ccc(Cl)cc3)N=N2)cc(Br)c1O,C39584689_decoy,WEE1,Decoy,0.0,-7.86853,-5.36,-0.79,-5.446642274865387
CNC(=O)c1c(NC(=O)c2cc(=O)oc3cc(OC(C)C)ccc23)sc2c1CCCC2,C41552072_decoy,WEE1,Decoy,0.0,-8.8009,-9.94,-2.51,-8.617338813879094
COc1ccccc1[C@@H]1[NH2+][C@@](C(=O)[O-])(c2ccccc2)[C@@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C43218760_decoy,WEE1,Decoy,0.0,-8.12703,-5.64,-1.68,-5.516497602435095
COc1cc(OC)c([C@@H]2[C@@H]3C[C@H](C(C)(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OC,C43409596_decoy,WEE1,Decoy,0.0,-7.13814,-5.22,-2.26,-3.816479156086326
COc1cc2ccccc2cc1C(=O)Nc1sc2c(c1C(=O)NC(=O)N(C)C)CCC2,C44452746_decoy,WEE1,Decoy,0.0,-9.35239,-8.99,-2.17,-9.122048740395938
C[C@H]1C[C@@H](C(F)F)n2nc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C(C)(C)C)C4)nc2N1,C09059459_decoy,WEE1,Decoy,0.0,-9.40859,-9.29,-0.18,-17.258621457019448
Cc1cc(C)nc(NNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCCC3)n1,C59290555_decoy,WEE1,Decoy,0.0,-9.81935,-10.09,-2.57,-10.698752726389154
Cc1cc(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)c2c(C)nn(C)c2n1,C59813206_decoy,WEE1,Decoy,0.0,-8.05725,-10.06,-3.65,-8.393051013614631
CCCC1=NN=C2OC(N)=C(C#N)[C@]3(C(=O)N(Cc4ccc(Cl)cc4)c4ccccc43)[C@H]12,C09210270_decoy,WEE1,Decoy,0.0,-6.37447,-5.08,-3.12,-2.9081594732982508
CC(C)C1=NN=C2OC(N)=C(C#N)[C@@]3(C(=O)N(Cc4ccc(Cl)cc4)c4ccccc43)[C@H]21,C09281352_decoy,WEE1,Decoy,0.0,-6.23135,-5.49,-2.05,-3.2475045589114893
Cc1c(-c2ccc(F)cc2)nn2c1N=C(O)C[C@@H]2C(=O)Nc1cccc(OC(F)(F)F)c1,C35685008_decoy,WEE1,Decoy,0.0,-8.26578,-10.64,-2.62,-8.191757727907904
Cc1ccsc1[C@@H]1C(C#N)=C(N)N(c2ccc([N+](=O)[O-])cc2)C2=C1C(=O)CC(C)(C)C2,C08442832_decoy,WEE1,Decoy,0.0,-7.94895,-7.42,-0.8,-6.746990581023289
NC(=O)[C@H]1CN(C(=O)/C=C/c2cn(-c3ccccc3)nc2-c2cccs2)c2ccccc2O1,C09224021_decoy,WEE1,Decoy,0.0,-9.39036,-10.29,-2.24,-11.996858588412126
O=C(CSc1nnc(-c2ccccc2Br)o1)NC(=O)NC1CCCC1,C09390366_decoy,WEE1,Decoy,0.0,-9.53418,-7.28,-1.99,-6.997505984583648
CCOC(=O)C1=C(N)OC2=C(C(=O)CCC2)[C@@]12C(=O)N(Cc1ccccc1)c1ccccc12,C09510383_decoy,WEE1,Decoy,0.0,-6.65108,-4.93,-2.98,-3.5731409152286018
NC(=O)[C@@H]1CN(C(=O)c2cc(-c3cccs3)nn2-c2ccccc2)c2ccccc2O1,C09595252_decoy,WEE1,Decoy,0.0,-7.32107,-9.63,-5.15,-5.871463770762677
Cc1nc(-c2ccc(NC(=O)CN3C(=O)N[C@@]4(C[C@H](C)CC(C)(C)C4)C3=O)cc2)cs1,C09866034_decoy,WEE1,Decoy,0.0,-8.25577,-6.62,-1.18,-5.4240398280276985
CNC(=O)NC(=O)[C@H](C)Sc1nc2cc(Cl)ccc2c(=O)n1-c1ccc(C)cc1,C12755892_decoy,WEE1,Decoy,0.0,-8.26319,-8.77,-0.5,-9.295435538372724
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1nc(-c2cccc(Br)c2)no1,C12789683_decoy,WEE1,Decoy,0.0,-8.93418,-9.38,-1.68,-10.35005527857051
CC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N1CCN(C(=O)Nc2ccccc2C)CC1,C13084773_decoy,WEE1,Decoy,0.0,-7.66764,-7.52,-4.41,-6.327116336808636
C[C@@H]1CCc2c(sc3nc(SCC(=O)O[C@H]4CCS(=O)(=O)C4)nc(N)c23)C1,C12557557_decoy,WEE1,Decoy,0.0,-10.1692,-8.89,-0.26,-11.697176394827828
O=C(Nc1nccs1)c1ccc2nc(NS(=O)(=O)c3ccc(F)cc3)sc2c1,C13719730_decoy,WEE1,Decoy,0.0,-9.49526,-9.74,-0.94,-9.087876419784417
CC(=O)Nc1c(-c2ccc(F)cc2)c(C)nn1-c1ccc(C(=O)Nc2nc(C)cs2)cc1,C15864405_decoy,WEE1,Decoy,0.0,-8.20175,-7.17,-3.02,-7.467799448926828
O=C(NC1CCCCC1)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1,C17357306_decoy,WEE1,Decoy,0.0,-8.75025,-6.47,-0.44,-7.599776602934555
Cc1cc(C(=O)N2CCC[C@H](C(=O)Nc3cccc(-c4cc5ccccc5[nH]4)c3)C2)no1,C19636546_decoy,WEE1,Decoy,0.0,-7.03019,-7.78,-3.3,-5.9862389572109285
Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)N(C4CC4)[C@H](C(=O)NC4CCCCC4)[C@]34C=C[C@H]2O4)cc1,C20106871_decoy,WEE1,Decoy,0.0,-8.4921,-5.47,-1.75,-5.274983683967591
N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc(Cl)c2)[C@H]2CN(C(=O)OC(F)(F)F)CC=C12,C20792348_decoy,WEE1,Decoy,0.0,-7.64537,-9.39,-0.59,-8.720843137140333
CC(=O)Nc1cccc(NC(=O)[C@H]2CCCN(c3ccc(-c4cccs4)nn3)C2)c1,C22487203_decoy,WEE1,Decoy,0.0,-10.2652,-5.65,-1.79,-6.458476241830179
[O-]c1c([C@@H](c2ccc(Cl)cc2)[NH+]2CCC(O)CC2)sc2nc(-c3ccco3)nn12,C22852005_decoy,WEE1,Decoy,0.0,-8.12229,-8.31,-4.09,-7.628490273577985
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc3c(s2)CCCCC3)C1,C24705305_decoy,WEE1,Decoy,0.0,-7.75499,-8.15,-4.27,-6.759993237497832
Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21,C25852159_decoy,WEE1,Decoy,0.0,-8.56612,-9.52,-1.0,-6.743229454649748
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1,C26809050_decoy,WEE1,Decoy,0.0,-8.32824,-9.37,-4.97,-4.625014884146965
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N/N=C/c3c[nH]c4ccccc34)CC2)cc1,C27500571_decoy,WEE1,Decoy,0.0,-8.24198,-6.23,-1.97,-5.49562542396385
COc1ccc2nc(C)c(C(=O)Nc3nc(-c4ccc(NC(C)=O)cc4)cs3)cc2c1,C29770030_decoy,WEE1,Decoy,0.0,-8.71929,-8.94,-1.61,-7.002491767041048
Cc1ccc(-c2nn3c(C)nnc3s2)cc1NC(=S)NC(=O)c1ccc(F)cc1,C32127688_decoy,WEE1,Decoy,0.0,-9.15658,-9.2,-1.63,-8.35353690371714
O=C(Nc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)[C@H]1COc2ccccc2O1,C32678540_decoy,WEE1,Decoy,0.0,-9.06334,-10.17,-1.83,-14.0140822041557
CC(=O)Nc1cc(C)nn1-c1ccc(NC(=O)c2csc(-c3ccc(C)cc3)n2)cc1,C32832440_decoy,WEE1,Decoy,0.0,-9.50816,-8.86,-1.97,-8.101630407250239
Cc1ccc(NC(=O)c2nnc([C@H]3CCCN(C(=O)Nc4ccccc4)C3)s2)cc1,C33113282_decoy,WEE1,Decoy,0.0,-8.04062,-8.88,-1.9,-6.923610997048025
O=C(Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1)[C@@H]1COc2ccc(Cl)cc2C1,C35338802_decoy,WEE1,Decoy,0.0,-8.50339,-9.85,-1.89,-7.96495150812483
NC(=O)C1CCN(c2oc(-c3ccc(F)cc3)nc2S(=O)(=O)c2ccc(F)cc2)CC1,C36293381_decoy,WEE1,Decoy,0.0,-7.85397,-6.01,-4.14,-4.98246166509083
CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F,C02151697_decoy,WEE1,Decoy,0.0,-7.9722,-9.55,-3.72,-7.955699809048055
C#CCN1C(=O)[C@]2(C(C#N)=C(N)OC(C)=C2C(=O)OCc2ccccc2)c2ccccc21,C02211847_decoy,WEE1,Decoy,0.0,-7.24538,-3.86,-1.77,-3.9796045853993456
COc1cc(Br)c(Br)c(/C=N\NC(=O)[C@@H]2C=C(C)N=N2)c1O,C38611404_decoy,WEE1,Decoy,0.0,-7.99671,-7.7,-1.74,-8.78655294455945
O=C(Nc1ccc(S(=O)(=O)NC23CC4CC(CC(C4)C2)C3)cc1)[C@@H]1N=NC=C1Cl,C39444819_decoy,WEE1,Decoy,0.0,-8.11951,-6.22,-1.36,-5.452518768142821
CC(=O)Nc1cccc(NC(=O)CSC2=NC(=O)C3=C4CC[C@@H](C)C[C@@H]4SC3=N2)c1,C40010058_decoy,WEE1,Decoy,0.0,-10.2729,-8.56,-1.55,-8.790839872749018
CC(=O)Nc1ccc(NC(=O)c2ccc(-n3nncc3-c3ccc(Cl)cc3)cc2)cc1,C40180275_decoy,WEE1,Decoy,0.0,-8.47435,-8.61,-1.53,-7.54359695305875
CC[C@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cncc(Br)c1)CCC2,C40822878_decoy,WEE1,Decoy,0.0,-8.84055,-8.71,-1.12,-8.262956534513659
Cc1c(C(=O)NNC(=O)c2cnn(-c3ccc(Br)cc3)c2C)oc2ccccc12,C45549139_decoy,WEE1,Decoy,0.0,-7.85625,-5.65,-0.33,-5.353989122918756
C[C@H]1CCc2c(sc(N[C@H]3OC(=O)c4ccccc43)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C47136010_decoy,WEE1,Decoy,0.0,-9.05873,-9.3,-2.24,-8.416011162313021
Cc1cc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@H](c2ccc(Cl)cc2)N3)no1,C02261981_decoy,WEE1,Decoy,0.0,-6.55188,-4.99,-1.42,-4.072976977412673
CC(C)Oc1ccc([C@@H]2SCC(=O)Nc3c2c(O)nn3[C@H]2CCOC(C)(C)C2)cc1,C02363662_decoy,WEE1,Decoy,0.0,-10.2641,-4.85,-1.94,-6.4158942683423215
O=C(Nc1cccc(NC(=O)c2cccs2)c1)c1cccc(N2CCCS2(=O)=O)c1,C24033758_decoy,WEE1,Decoy,0.0,-9.47693,-8.98,-1.96,-10.934861761583422
CC(=O)N1CCc2cc(NC(=O)Nc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)ccc21,C58376881_decoy,WEE1,Decoy,0.0,-8.04457,-10.6,-0.5,-7.883302677536255
COc1ccc(OC)c(NC(=O)C2=C(C)N(C)C(=S)N[C@H]2c2cccc(C#N)c2)c1,C22827661_decoy,WEE1,Decoy,0.0,-10.2772,-6.27,-2.14,-8.366592057709594
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)Nc3ccc4[nH]c(C5CCC5)nc4c3)C2)s1,C60331840_decoy,WEE1,Decoy,0.0,-10.209,-8.67,-2.27,-12.91732990820461
CCCC1=NN=C2OC(N)=C(C#N)[C@@]3(C(=O)N(Cc4cccc(F)c4)c4ccccc43)[C@H]12,C09307054_decoy,WEE1,Decoy,0.0,-5.93575,-5.1,-1.82,-3.6248633345249512
COc1ccc(/C=C/C(=O)/N=C2\N=C(C)[C@H]([C@H]3N[C@H](c4cccs4)NO3)S2)cc1,C63807356_decoy,WEE1,Decoy,0.0,-8.66481,-8.12,-1.8,-7.450129993895879
C[C@H](NC(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(=O)NC1=CC2=CC=N[C@@H]2C=C1,C64435660_decoy,WEE1,Decoy,0.0,-9.10955,-8.63,-3.62,-7.55956218032378
Cc1ccc(NC(=O)[C@H]2CC(=O)NC3=NC(SCc4cccc(F)c4)=NC(=O)[C@@H]32)c(C)c1,C64742813_decoy,WEE1,Decoy,0.0,-9.05028,-5.52,-1.32,-4.788489110389173
O=C(Nc1ccc(F)cc1)c1nnc([C@@H]2CCCN2C(=O)NCc2ccc(F)cc2)s1,C64930547_decoy,WEE1,Decoy,0.0,-8.36575,-6.16,-3.12,-5.4427268504416775
Cc1nc(C)c2c(C)c(C(=O)N3CCC(NC(=O)NC4CCCCC4)CC3)sc2n1,C65594241_decoy,WEE1,Decoy,0.0,-7.56624,-9.31,-2.05,-6.936854611125135
O=C(Nc1ccccc1)Nc1ccc2n(c1=O)C[C@H]1C[C@@H]2CN(C(=O)c2ccc3ccccc3c2)C1,C04258889_decoy,WEE1,Decoy,0.0,-7.97965,-7.09,-2.75,-5.502449728305733
COC(=O)C1=C(N)N(c2ccccc2F)C2=C(C(=O)CC(C)(C)C2)[C@@H]1c1ccc2c(c1)OCO2,C00714618_decoy,WEE1,Decoy,0.0,-7.88588,-5.52,-1.1,-5.314027883812425
N#CC1=C(N)N(c2ccccc2C#N)C2=C(C(=O)C[C@H](c3ccccc3)C2)[C@H]1c1ccc2c(c1)OCO2,C00673420_decoy,WEE1,Decoy,0.0,-7.98218,-5.54,-1.24,-4.690093756172772
Cc1ccc(CN2C(=O)[C@]3(C(C#N)=C(N)Oc4c3c(C)nn4-c3ccccc3)c3ccccc32)cc1,C02428098_decoy,WEE1,Decoy,0.0,-7.25205,-6.15,-0.91,-4.338588728564154
COc1ccc(C(=O)Nc2nc3c(s2)CCC[C@@H]3C(=O)Nc2nc3ccccc3s2)cc1,C09101540_decoy,WEE1,Decoy,0.0,-9.55617,-9.35,-2.48,-9.882525623014349
CSc1ccccc1NC(=O)[C@@H]1CCCc2sc(NC(=O)c3ccc4c(c3)OCO4)nc21,C09104403_decoy,WEE1,Decoy,0.0,-9.97378,9.56,-2.24,-0.1993060053679712
Cc1cc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@@H](c2ccccc2)N3)n(-c2ccccc2)n1,C09183784_decoy,WEE1,Decoy,0.0,-8.3547,-8.92,-2.96,-7.92971662622951
CCOc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc(Br)c1OCC,C09296361_decoy,WEE1,Decoy,0.0,-8.42619,-8.42,-4.34,-7.806313124264587
C[C@H]1CCc2c(sc(NC(=O)c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](c3ccco3)N4)c2C#N)C1,C09305250_decoy,WEE1,Decoy,0.0,-9.13337,-8.78,-3.15,-7.758500027826425
O=C(NCc1ccc(F)cc1)c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccc3c(c1)OCO3)N2,C09435604_decoy,WEE1,Decoy,0.0,-8.25578,-9.24,-4.17,-7.057925308365664
N#CC1=C(N)N(c2ccc(Br)cc2)C2=C(C(=O)CCC2)[C@H]1c1ccc([N+](=O)[O-])cc1,C01056560_decoy,WEE1,Decoy,0.0,-6.91268,-5.19,-0.39,-4.138920034686831
NC(=O)[C@@H]1CN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)c2ccccc2O1,C12694707_decoy,WEE1,Decoy,0.0,-8.32633,-6.74,-1.79,-5.937883063955285
O=C(Nc1nc(-c2ccc3c(c2)OCCO3)cs1)c1ccc(NC(=O)c2cccs2)cc1,C13117771_decoy,WEE1,Decoy,0.0,-9.49858,-8.06,-4.24,-7.029005411808161
CCOC(=O)C1=C(N)N(c2ccc(F)cc2)C2=C(C(=O)CC(C)(C)C2)[C@@H]1c1ccc2c(c1)OCO2,C09761313_decoy,WEE1,Decoy,0.0,-6.93145,-4.9,-1.74,-4.54907157285641
CSc1nc(SCC(N)=O)c2sc3nc(-c4ccco4)c4c(c3c2n1)CC(C)(C)OC4,C02407377_decoy,WEE1,Decoy,0.0,-10.8941,-8.47,-1.01,-15.409816272468763
Cc1ccc(-c2nc3cc(NC(=S)NC(=O)c4ccc5c(c4)OCCO5)ccc3o2)cc1C,C14269416_decoy,WEE1,Decoy,0.0,-11.3164,-10.26,-3.34,-9.200466950571922
CNC(=O)NC(=O)CSc1nc2sc3c(c2c(=O)n1-c1cc(C)ccc1C)CCCC3,C09966207_decoy,WEE1,Decoy,0.0,-8.94543,-8.36,-3.34,-8.208430369249623
C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NCc1ccc(-c3ccc(Br)cc3)o1)C2=O,C15543976_decoy,WEE1,Decoy,0.0,-7.76818,-9.54,-1.82,-8.897523922174654
O=S(=O)(/N=C1\CCCCCN1)c1cccc(NS(=O)(=O)c2ccc3ccccc3c2)c1,C16154818_decoy,WEE1,Decoy,0.0,-7.51577,-10.8,-2.87,-9.352004916174094
CC(C)(C)OC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(Br)c3)[C@H]2C1,C08411495_decoy,WEE1,Decoy,0.0,-8.27617,-4.72,-1.23,-4.5398271464721045
COc1ccc([C@@H]2C(C(=O)Nc3ccc(C)cn3)=C(C)NC3=C2C(=O)C[C@H](c2ccco2)C3)cc1,C13059384_decoy,WEE1,Decoy,0.0,-8.48651,-5.99,-1.92,-5.467799027775814
CNC(=O)NC(=O)CSc1nc2sc3c(c2c(=O)n1-c1ccc(C)c(C)c1)CCCC3,C10438430_decoy,WEE1,Decoy,0.0,-8.63087,-6.6,-2.31,-6.0395512504922895
C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNc3nc4c(F)cc(F)cc4s3)cc2)C1,C17244463_decoy,WEE1,Decoy,0.0,-10.0578,-10.43,-1.91,-8.51054810945216
CC(=O)N1CCc2cc(NC(=O)c3ccc(C)c(S(=O)(=O)Nc4ccc(C)cc4)c3)ccc21,C24093865_decoy,WEE1,Decoy,0.0,-8.9781,-11.27,-1.03,-23.152197898479965
N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc(Cl)c2)[C@@H]2CN(C(=O)OCc3ccccc3)CC=C12,C09112983_decoy,WEE1,Decoy,0.0,-7.5216,-4.65,-1.49,-4.157877691499046
N#CC1=C(N)C(C#N)(C#N)[C@@H](c2cccc(Cl)c2)[C@H]2CN(C(=O)OCc3ccccc3)CC=C12,C09113314_decoy,WEE1,Decoy,0.0,-7.68927,-6.58,-2.21,-5.6630831906806325
Cc1ccc(-c2nn3c(C)nnc3s2)cc1NC(=S)NC(=O)c1cccc(Br)c1,C32126630_decoy,WEE1,Decoy,0.0,-9.98471,-9.68,-1.57,-10.187053915812395
COC(=O)[C@@H]1[C@H](c2cccc(F)c2)NC(=S)N(c2ccc3c(c2)OCCO3)[C@]1(O)C(C)C,C34791854_decoy,WEE1,Decoy,0.0,-7.24267,-4.69,-1.11,-3.696805201256879
Cc1ccc(C(=O)NC2CCC(Nc3nc(C)nc4c3cnn4-c3ccccc3F)CC2)cc1,C35644316_decoy,WEE1,Decoy,0.0,-8.84668,-6.44,-1.56,-4.812138614544083
Cc1ccc(-n2ncc3c(NC4CCC(NC(=O)c5ccccc5F)CC4)nc(C)nc32)c(C)c1,C36025896_decoy,WEE1,Decoy,0.0,-8.76644,-9.7,-3.31,-12.768277578489082
COC(=O)[C@H]1[C@H](c2ccc(F)cc2F)NC(=S)N(c2ccc3c(c2)OCCO3)[C@]1(O)C(C)C,C37462305_decoy,WEE1,Decoy,0.0,-8.45795,-4.73,-2.21,-4.931555827452709
N#CC1=C(N)OC2=NN=C(c3ccc(Br)cc3)[C@H]2[C@H]1[C@@H]1C=NN=C1c1ccc(F)cc1,C39210897_decoy,WEE1,Decoy,0.0,-6.87797,-5.76,-0.76,-5.0812188892806525
N#CC1=C(N)OC2=NN=C(c3cccs3)[C@@H]2[C@@H]1c1cn(-c2ccccc2)nc1-c1ccccc1,C00987151_decoy,WEE1,Decoy,0.0,-7.28089,-5.7,-1.94,-4.035427824029115
Cc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@]4(C(=O)N(CCc5ccccc5)c5ccccc54)[C@H]32)cc1,C08557885_decoy,WEE1,Decoy,0.0,-5.51534,-6.01,-3.21,-4.073118410493297
CN(C)c1ccc([C@@H]2[NH2+][C@@](C(=O)[O-])(c3ccccc3)[C@@H]3C(=O)N(C4CCCCC4)C(=O)[C@H]32)cc1,C43218948_decoy,WEE1,Decoy,0.0,-9.25768,-4.97,-1.5,-5.689001447936961
CSc1ccc(NC(=O)[C@@H]2CCCc3sc(NC(=O)c4ccc5c(c4)OCO5)nc32)cc1,C44441349_decoy,WEE1,Decoy,0.0,-10.5068,-9.15,-4.13,-7.864852623262053
O=C(Nc1nonc1NC(=O)c1ccc(Br)cc1)c1ccc(Br)cc1,C45336405_decoy,WEE1,Decoy,0.0,-8.29697,-5.47,-0.23,-5.297881824320794
Cc1cc(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)c2nc3n(c2n1)CCCCC3,C46757757_decoy,WEE1,Decoy,0.0,-9.30411,-6.53,-2.38,-5.872389830800692
CC(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)N(S(=O)(=O)c2ccc(F)cc2)CCC3)cc1,C49491760_decoy,WEE1,Decoy,0.0,-8.47618,-8.69,-2.9,-6.694399762412829
C[C@@H]1Cc2cc(C(=O)Nc3ccc4nc(-c5ccc(F)cc5)[nH]c4c3)ccc2N1S(C)(=O)=O,C32933121_decoy,WEE1,Decoy,0.0,-8.23603,-10.38,-0.7,-7.302359684142192
O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1cc(Br)cc(Br)c1O,C09028321_decoy,WEE1,Decoy,0.0,-7.99749,-9.74,-1.87,-8.045822352880986
C[C@@H](NC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1)c1nc2ccccc2[nH]1,C57744231_decoy,WEE1,Decoy,0.0,-9.84586,-8.55,-3.19,-7.144669307328308
O=C(Nc1cccnc1)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1ccc(Br)cc1,C59168060_decoy,WEE1,Decoy,0.0,-8.3925,-9.63,-2.72,-8.687405514830482
Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1,C59776178_decoy,WEE1,Decoy,0.0,-8.70591,-10.05,-4.35,-8.319283294609347
O=C(N/N=C/c1ccccc1O)C1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1,C59921061_decoy,WEE1,Decoy,0.0,-8.92438,-8.11,-2.66,-6.873730013294617
O=C(Nc1ccc2c(c1)CCC2)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc3c(c1)OCO3)N2,C12847025_decoy,WEE1,Decoy,0.0,-8.11886,-10.86,-2.55,-6.115061086230949
N#CC1=C(N)OC2=NN=C(c3ccccc3)[C@@H]2[C@@]12C(=O)N(Cc1ccc(Cl)cc1)c1ccccc12,C09159357_decoy,WEE1,Decoy,0.0,-6.84039,-4.78,-1.66,-3.850611165835256
CCC(=O)Nc1ccc(S(=O)(=O)N2CCC3(CC2)Nc2cc(C)ccc2-n2cccc23)cc1,C35399281_decoy,WEE1,Decoy,0.0,-8.29475,-8.17,-1.63,-6.398986553585887
Cn1nc(C(=O)Nc2ccccc2)c2c1CCN(C(=O)Nc1ccc(Br)cc1F)C2,C64893868_decoy,WEE1,Decoy,0.0,-9.6209,-10.85,-3.12,-12.726422147824048
Cc1ccc(NC(=O)c2nnn(CC(=O)Nc3ccc(Cl)cc3)c2C)c(Br)c1,C67322466_decoy,WEE1,Decoy,0.0,-8.08687,-5.71,-2.87,-4.744583188477646
COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC(=O)Nc1cccc(NC(C)=O)c1,C03427065_decoy,WEE1,Decoy,0.0,-7.97169,-10.2,-3.95,-8.854735652668161
COC(=O)c1c(NC(=O)c2sc3nc(C(F)(F)F)cc(-c4ccco4)c3c2N)sc(C)c1C,C02089875_decoy,WEE1,Decoy,0.0,-8.45097,-5.86,-4.28,-5.185680910087837
O=C(N[C@H](NC(=S)Nc1ccc2ccccc2c1)C(Cl)(Cl)Cl)c1cccc([N+](=O)[O-])c1,C03142232_decoy,WEE1,Decoy,0.0,-8.73702,-9.16,-1.82,-9.312486838575436
CCCCOC(=O)c1ccc(-n2c(N)c(C(=O)NCc3cccs3)c3nc4ccccc4nc32)cc1,C02265060_decoy,WEE1,Decoy,0.0,-9.92428,-8.33,-4.04,-7.749451161553525
O=C(CSc1nnc(-c2ccc(Cl)cc2)n1C1CCCCC1)NNC(=S)Nc1ccccc1,C09113689_decoy,WEE1,Decoy,0.0,-8.99963,-7.93,-1.81,-6.464624641620211
CC[C@@H](C)Oc1cccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)Nc3cc(C)cc(C)c3)cc2)c1,C10121225_decoy,WEE1,Decoy,0.0,-10.0304,-8.71,-1.88,-8.136075673238983
CC[C@@H](C)Oc1cccc(C(=O)NC(=S)Nc2ccc(S(=O)(=O)Nc3c(C)cccc3C)cc2)c1,C10121229_decoy,WEE1,Decoy,0.0,-11.1759,-8.24,-2.73,-7.887245106846113
Cc1ccc(Oc2ccccc2NC(=O)CSc2nnc(-c3ccc(OC(F)F)cc3)n2N)cc1,C11388669_decoy,WEE1,Decoy,0.0,-8.98673,-8.16,-1.16,-8.920266513480424
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccc(Cl)cc3Cl)cc2)c1,C12495459_decoy,WEE1,Decoy,0.0,-9.79205,-9.33,-3.54,-8.813883299602354
Cn1c(NC(=O)NNc2ncc(C(F)(F)F)cc2Cl)cnc1Sc1ncc(C(F)(F)F)cc1Cl,C12955759_decoy,WEE1,Decoy,0.0,-8.01872,-7.56,-3.04,-6.046083255648178
CCc1nc(N)sc1C(=O)N/N=C/c1ccc(-n2nc(-c3ccccc3)cc2[C@H]2C=CC=CC2)cc1,C08800966_decoy,WEE1,Decoy,0.0,-9.01748,-7.09,-2.19,-7.276826859360716
COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1OC,C13632786_decoy,WEE1,Decoy,0.0,-10.3167,-9.76,-2.25,-8.015706564248148
CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=S)NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc2)cc1,C13632920_decoy,WEE1,Decoy,0.0,-8.28818,-10.01,-4.14,-7.668831697808885
Cc1cc(NC(=S)NC(=O)c2cccc(OCC(C)C)c2)ccc1NC(=O)c1cc2ccccc2o1,C14273958_decoy,WEE1,Decoy,0.0,-10.1907,-9.32,-2.33,-8.048645851443203
COc1ccc(C(=O)NNC(=S)NC(=O)c2cc(Br)ccc2OCCC(C)C)cc1,C14651226_decoy,WEE1,Decoy,0.0,-9.28866,-7.98,-1.04,-9.179789931445692
CCCOc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)COc1cccc2ccccc12,C14654148_decoy,WEE1,Decoy,0.0,-8.62819,-8.07,-2.19,-8.06766995418112
CC(C)Oc1ccccc1C(=O)NC(=S)NNC(=O)COc1ccc2ccccc2c1Br,C14664698_decoy,WEE1,Decoy,0.0,-9.27668,-8.19,-2.41,-9.325147094521046
CC(C)Oc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)COc1ccccc1C(C)C,C14668604_decoy,WEE1,Decoy,0.0,-9.22499,-8.09,-3.2,-8.616692181780154
Cc1cc(Cl)ccc1OCC(=O)NNC(=S)NC(=O)c1cc(Br)ccc1OC(C)C,C14668662_decoy,WEE1,Decoy,0.0,-8.85863,-7.36,-2.05,-7.414948895353963
CC[C@H](C)NC(=O)c1ccccc1NC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc(C)cc2C)c1,C16448595_decoy,WEE1,Decoy,0.0,-8.68447,-10.36,-4.08,-8.938400243617638
CC[C@H](C)[C@@H](NC(=O)NC1CCCCC1)C(=O)Nc1nnc(-c2ccc(Br)cc2)s1,C16572317_decoy,WEE1,Decoy,0.0,-9.05361,-8.34,-1.29,-7.976265047154871
CCN1C(=S)N[C@H](c2ccc(NC(=O)Nc3ccccc3OC)cc2)C(C(=O)OCC(C)C)=C1C,C16610526_decoy,WEE1,Decoy,0.0,-9.3424,-8.42,-4.79,-7.37871140631764
Cc1ccc(-c2nnc(NC(=O)[C@H](NC(=O)Nc3c(C(C)C)cccc3C(C)C)C(C)C)s2)cc1,C16614614_decoy,WEE1,Decoy,0.0,-9.4481,-7.6,-2.64,-7.217543324281085
CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2ccc(C)cc2C)N1,C01305059_decoy,WEE1,Decoy,0.0,-7.71899,-9.33,-2.11,-7.806291469610007
CCOC(=O)c1cc(Cc2ccccc2)sc1NC(=S)NNC(=O)c1ccc(Br)o1,C20168670_decoy,WEE1,Decoy,0.0,-9.76794,-7.16,-0.62,-8.765261393063343
CC[C@@H](C)c1ccc(NC(=O)CCSc2n[nH]c(N/N=C/c3ccc(Br)cc3)n2)cc1,C20833698_decoy,WEE1,Decoy,0.0,-10.0914,-7.98,-4.46,-9.169088382221984
C/C(=N\Nc1nc(SCCC(=O)Nc2nc3ccccc3s2)n[nH]1)C12CC3CC(CC(C3)C1)C2,C20837404_decoy,WEE1,Decoy,0.0,-9.96302,-8.86,-2.8,-7.571649170374153
C/C(=N\Nc1nnc(SCC(=O)c2ccc(Br)cc2)n1N)c1ccc2ccccc2c1,C21323622_decoy,WEE1,Decoy,0.0,-8.75739,-5.86,-3.02,-4.5475937651490925
COc1ccc([C@H]2N=C(Nc3nc4ccccc4s3)NC(C)=C2C(=O)Nc2ccccc2)cc1OC,C22820697_decoy,WEE1,Decoy,0.0,-8.98844,-6.92,-2.66,-6.2484516600605
CNC(=O)c1cccc(NC(=O)c2cccc(NS(=O)(=O)c3cc(C(C)(C)C)ccc3C)c2)c1C,C31991958_decoy,WEE1,Decoy,0.0,-9.64579,-10.23,-3.22,-7.70709912407219
CCOC(=O)c1c(NC(=O)CSc2nc3cc(C)ccc3[nH]2)sc(C(=O)Nc2ccccc2)c1C,C32697618_decoy,WEE1,Decoy,0.0,-10.1351,-9.38,-0.76,-9.633490167119414
CSc1cccc(NC(=O)Nc2ccc3nc(SCC(=O)Nc4cccc(C)c4)sc3c2)c1,C33018994_decoy,WEE1,Decoy,0.0,-9.9712,-9.06,-4.41,-8.177802341593416
CCOC(=O)[C@H](C)Oc1ccc([C@@H]2NC(=S)NC(c3ccccc3)=C2C(=O)Nc2ccc(C)cc2)cc1,C02143058_decoy,WEE1,Decoy,0.0,-9.13494,-8.4,-4.32,-9.742358715903402
CC[C@@H](C)[C@H](NC(=O)Nc1cccc2ccccc12)C(=O)Nc1nnc(-c2ccc(N(C)C)cc2)s1,C35300897_decoy,WEE1,Decoy,0.0,-9.66876,-8.28,-2.71,-7.656958532022891
Cc1ccccc1NC(=O)NCCN(CCO[C@@H]1C[C@H]2CC[C@]1(C)C2(C)C)C(=O)Nc1ccccc1C,C35489157_decoy,WEE1,Decoy,0.0,-8.81162,-8.69,-3.19,-9.98577646009874
CCCN1C(=O)N[C@H](c2ccc(NC(=O)Nc3ccc(F)c(F)c3)cc2)C(C(=O)OCC(C)C)=C1C,C35711721_decoy,WEE1,Decoy,0.0,-7.24216,-8.24,-2.94,-6.362378288806872
CCCN1C(=O)N[C@H](c2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)C(C(=O)OCC)=C1C,C35711991_decoy,WEE1,Decoy,0.0,-8.74145,-8.17,-4.62,-7.629065775838791
CC[C@@H](C)[C@@H](NC(=O)Nc1c(C(C)C)cccc1C(C)C)C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C35724594_decoy,WEE1,Decoy,0.0,-8.3132,-8.0,-3.53,-5.7825763772518055
CCN(CC)c1ccc(/C=N/NC(=O)/C(=C\c2ccc(N(C)C)cc2)NC(=O)c2ccccc2)c(O)c1,C36235453_decoy,WEE1,Decoy,0.0,-9.38342,-9.94,-3.12,-8.905690502127813
CCOC(=O)C1=C(C)Nc2sc(C(=O)c3ccc(F)cc3)c(N)c2[C@@H]1c1ccc(C(=O)OC)cc1,C08733677_decoy,WEE1,Decoy,0.0,-9.16308,-5.9,-3.95,-5.486345871910956
CC1=C(C(N)=O)[C@@H](c2cc(Br)ccc2OCc2ccc(C(C)(C)C)cc2)N2NN=NC2=N1,C27563802_decoy,WEE1,Decoy,0.0,-9.2221,-5.95,-1.34,-7.3635964874406
O=C(c1ccccc1O)[C@@H](c1ccccc1O)[C@H](NC(=O)S(=O)(=O)Oc1ccccc1)c1ccccc1,C39494869_decoy,WEE1,Decoy,0.0,-8.58706,-6.11,-3.04,-5.940183036705531
O=C(N/N=C/c1ccc(I)o1)/C(=C/c1ccccc1O)NC(=O)c1ccccc1,C08856240_decoy,WEE1,Decoy,0.0,-8.79152,-8.91,-2.43,-9.312771407551848
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C=C/c3ccc(-c4ccccc4[N+](=O)[O-])o3)c2C(N)=O)C1,C57316099_decoy,WEE1,Decoy,0.0,-9.22128,-9.32,-1.38,-13.951708318371114
C/C(=N/Nc1nc(SCC(=O)Nc2ccccc2SCc2ccccc2)n[nH]1)c1ccc(F)cc1,C59021812_decoy,WEE1,Decoy,0.0,-8.50306,-9.3,-1.82,-8.378041449260765
Cc1cc(OCC(=O)NNC(=O)c2ccc(NC(=O)CC(C)C)cc2)c(C(C)C)cc1Br,C12494018_decoy,WEE1,Decoy,0.0,-8.48095,-9.11,-0.91,-8.96874086657537
C[C@H](NC(=O)c1cccc(NC(=O)CNc2ccc(C(=O)N(C)c3ccccc3)cc2)c1)c1ccccc1,C66092410_decoy,WEE1,Decoy,0.0,-7.22432,-9.24,-1.87,-6.721849389478524
CCN(C(=O)c1ccc(NC(=O)CNc2cccc(C(=O)N[C@H](C)c3ccccc3)c2)cc1)c1ccccc1,C66097164_decoy,WEE1,Decoy,0.0,-9.05819,-8.3,-4.42,-7.980496300061074
O=C(CNc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1)Nc1cccc(OC[C@H]2CCCO2)c1,C66107044_decoy,WEE1,Decoy,0.0,-9.95731,-10.44,-2.59,-10.697544975391065
O=C(CNc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1)Nc1ccccc1OC[C@H]1CCCO1,C66107053_decoy,WEE1,Decoy,0.0,-7.96627,-10.26,-2.81,-7.821385556236112
CCOC(=O)C[NH2+][C@H](c1ccccc1)c1cc(Br)ccc1NC(=O)c1ccc(Cl)cc1,C08682302_decoy,WEE1,Decoy,0.0,-9.11256,-9.33,-4.18,-9.349834034420146
O=C1C[C@@H](C(=O)Nc2ccc(Oc3ccccc3)cc2)NC(N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)=N1,C08758116_decoy,WEE1,Decoy,0.0,-10.5323,-8.62,-2.03,-8.213208234333305
Cc1sc(NC(=O)c2ccco2)c([C@H](Nc2cccc[nH+]2)c2cccc(Br)c2)c1C,C08763398_decoy,WEE1,Decoy,0.0,-10.3125,-4.38,-2.31,-6.151342988699473
S=C(NCC[NH+]1CCN(C(=S)NC23CC4CC(CC(C4)C2)C3)CC1)NC12CC3CC(CC(C3)C1)C2,C08887694_decoy,WEE1,Decoy,0.0,-9.11491,-8.4,-3.69,-6.994799619970911
O=C(NC(=S)Nc1ccc(N2CC[NH+](Cc3ccccc3F)CC2)cc1)c1cc2ccccc2o1,C08898054_decoy,WEE1,Decoy,0.0,-10.3512,-8.6,-3.41,-11.70902357312088
COc1ccc(/C=N/NC(=O)c2[nH+]c(Cl)c(Cl)c(N)c2Cl)cc1COc1ccc(F)cc1,C08951250_decoy,WEE1,Decoy,0.0,-10.2055,-9.01,-1.02,-8.238822802680597
CCOC(=O)c1[nH]c2ccc(Br)cc2c1NC(=O)CC[NH+]1C[C@@]2(C)C[C@@H]1CC(C)(C)C2,C02226158_decoy,WEE1,Decoy,0.0,-8.7635,-8.84,-1.7,-8.989492315178207
O=c1[nH]c(=O)n(-c2ccc(F)cc2)c2c1C(C(F)(F)F)(C(F)(F)F)[NH+]=C(CCc1ccccc1)N2,C09460737_decoy,WEE1,Decoy,0.0,-7.39967,-9.38,0.51,-8.144675304553752
COc1ccc(NC(=O)c2c(NC(=O)C[NH+]3CCC[C@@H](C)C3)sc3c2CC[C@@H](C(C)(C)C)C3)c(OC)c1,C09805431_decoy,WEE1,Decoy,0.0,-10.0135,-7.99,-3.2,-8.184696462643096
Cc1cc(C)cc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(NS(=O)(=O)c3cccs3)CC2)c1,C10216061_decoy,WEE1,Decoy,0.0,-10.8001,-6.88,-2.69,-6.503978074350613
CCOC(=O)c1c(NC(=O)C[NH+](C)C2CCCCC2)sc(C(=O)Nc2ccc(C)cc2C)c1C,C13038806_decoy,WEE1,Decoy,0.0,-10.1013,-8.96,-1.98,-8.599737969280357
Cc1ccccc1[C@@H]([NH2+]C1CCN(c2ccc(NC(=O)c3ccccc3F)cc2)CC1)c1ccncc1,C12152624_decoy,WEE1,Decoy,0.0,-8.80876,-7.1,-2.57,-7.023982359838564
C[C@H]([NH2+]CCC(=O)Nc1sc2c(c1C(=O)Nc1ccc(Br)cc1)CCC2)c1ccccc1,C15946935_decoy,WEE1,Decoy,0.0,-10.0196,-8.93,-3.06,-8.91319623955375
CC[NH+](CC(=O)Nc1ccccc1C(F)(F)F)CC(=O)Nc1sc2c(c1C(=O)OC)CCCC2,C16588674_decoy,WEE1,Decoy,0.0,-8.29694,-7.66,-3.13,-7.4349135117086576
COc1ccc(/C=N/NC(=O)c2cc(C(C)(C)C)[nH]n2)cc1C[NH+]1CCc2cc(OC)c(OC)cc2[C@@H]1C,C02946107_decoy,WEE1,Decoy,0.0,-10.2389,-7.29,-3.09,-7.3557873196615295
C[C@@H](Nc1cc(-c2c(-c3cccc(C(F)(F)F)c3)nc(C3CC[NH2+]CC3)n2C)ccn1)c1ccccc1,C21289779_decoy,WEE1,Decoy,0.0,-9.94229,-6.1,-2.96,-6.438624246208803
CCOC(=O)c1c(NC(=O)[C@@H](C)[NH2+]C2CCCCCCC2)sc2c1CCN(Cc1ccccc1)C2,C13131537_decoy,WEE1,Decoy,0.0,-10.4897,-9.18,-3.64,-8.137804148561644
CCOC(=O)[NH+]=c1ccc2c(CSc3nnc(Nc4ccccc4OC)s3)cc(O)oc-2c1,C28676923_decoy,WEE1,Decoy,0.0,-9.20809,-8.09,-0.89,-7.953519419548246
COc1ccc([C@@H](CNC(=O)c2ccc(NS(=O)(=O)c3ccc(F)c(C)c3)cc2)[NH+]2CCCC2)cc1,C33023399_decoy,WEE1,Decoy,0.0,-10.3317,-10.34,-4.81,-12.509432890852242
COc1ccc(S(=O)(=O)Nc2ccc(Nc3nc(N4CCCCC4)cc(C)[nH+]3)cc2)cc1OC,C33078179_decoy,WEE1,Decoy,0.0,-9.43448,-10.25,-1.79,-8.804754245890406
CCCC[C@@H](CC)C(=O)Nc1ccc([C@@H]2C(C(=O)Nc3ccc(OC)cc3)=C(C)[NH+]=C3SCCCN32)cc1,C33631716_decoy,WEE1,Decoy,0.0,-11.3433,-8.52,-3.63,-8.217998287712888
CCCCCCC(=O)Nc1cccc([C@H]2C(C(=O)Nc3ccccc3OC)=C(C)[NH+]=C3SCCCN32)c1,C35239606_decoy,WEE1,Decoy,0.0,-10.016,-5.96,-4.01,-5.25694862859002
CCCNC(=O)N1CCC[NH+](CC2=C(C(=O)OCC)[C@H](c3ccc(F)cc3)NC(=O)N2CC)CC1,C35642737_decoy,WEE1,Decoy,0.0,-8.03147,-4.55,-2.38,-5.178972423612843
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(CC)C(=O)N[C@@H]1c1ccc(C(C)C)cc1,C35664229_decoy,WEE1,Decoy,0.0,-8.00414,-7.97,-3.73,-7.513901900839506
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(CC)C(=O)N[C@@H]1c1cccc(F)c1,C35664237_decoy,WEE1,Decoy,0.0,-7.56305,-4.36,-4.21,-5.22984395772167
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)C)CC2)N(CC)C(=O)N[C@@H]1c1cccc(F)c1,C35664241_decoy,WEE1,Decoy,0.0,-7.15407,-4.29,-3.14,-4.946280948978892
C=CCN1C(=O)N[C@@H](c2ccsc2)C(C(=O)OCC)=C1C[NH+]1CCCN(C(=O)NCCC)CC1,C35664445_decoy,WEE1,Decoy,0.0,-9.26359,-5.29,-2.21,-7.066975103090806
O=C(NCCc1ccc(Cl)cc1Cl)[C@@H]1CSC2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)[NH2+]1,C35768258_decoy,WEE1,Decoy,0.0,-9.39234,-8.07,-3.31,-7.430607504121756
CC1(C)CC(NC(=O)[C@@H](NC(=O)C(c2ccccc2)c2ccccc2)c2ccccc2)CC(C)(C)[NH2+]1,C36584568_decoy,WEE1,Decoy,0.0,-8.72554,-9.83,-1.77,-8.772145038552287
Cc1cccc(N[C@@H](c2ccc(C(F)(F)F)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)[nH+]1,C38547622_decoy,WEE1,Decoy,0.0,-10.1516,-4.95,-3.47,-7.233612107220622
Cc1cc[nH+]c(N[C@H](c2ccc(Br)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547650_decoy,WEE1,Decoy,0.0,-10.7434,-5.3,-1.18,-5.373001034523452
Cc1cc[nH+]c(N[C@@H](c2cccc(Br)c2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547663_decoy,WEE1,Decoy,0.0,-10.9812,-5.2,-2.24,-7.087361210563957
CCCc1ccc([C@H](C[N-]S(=O)(=O)Oc2ccccc2)[NH+]2CC[NH2+][C@H](c3ccccc3O)C2)cc1,C39532683_decoy,WEE1,Decoy,0.0,-9.08306,-8.93,-2.31,-8.745763327717683
CCOC(=O)/[NH+]=c1/ccc2c(COC(=O)CNC(=O)C34CC5CC(CC(C5)C3)C4)cc(O)oc-2c1,C39640366_decoy,WEE1,Decoy,0.0,-9.43448,-9.96,-5.2,-6.156971919892818
CC[C@H](C(=O)N1C[C@H](C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39675374_decoy,WEE1,Decoy,0.0,-9.49366,-9.32,-3.14,-8.781759525090907
CCC[C@H](C)C(=O)N1C[C@H](C(=O)NC(c2ccc(OC)cc2)c2ccc(OC)cc2)C2(CC[NH2+]CC2)C1,C39676553_decoy,WEE1,Decoy,0.0,-7.5416,-8.19,-3.74,-7.048834168600211
CC[C@H](C(=O)N1C[C@@H](C(=O)NCc2ccccc2N2CCCCC2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39678324_decoy,WEE1,Decoy,0.0,-9.2652,-10.81,-4.12,-6.747946631584084
CC[C@@H](C(=O)N1C[C@@H](C(=O)NCCc2c[nH]c3c(C)cccc23)C2(CC[NH2+]CC2)C1)c1ccccc1,C39684170_decoy,WEE1,Decoy,0.0,-8.69247,-7.94,-2.16,-6.5320209273741545
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4ccc(-c5ccccc5F)o4)CC34CC[NH2+]CC4)c[nH]c12,C39684221_decoy,WEE1,Decoy,0.0,-8.58766,-5.97,-2.91,-6.086498110548781
COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)C3CC[NH+](Cc4cccc(C)c4)CC3)cc2)c1,C39758266_decoy,WEE1,Decoy,0.0,-9.90682,-7.7,-3.99,-8.019062146314008
CSCC[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)co1,C43218174_decoy,WEE1,Decoy,0.0,-10.5253,-6.21,-4.04,-8.126629824212056
C[C@@](CC1=c2ccccc2=[NH+]C1)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)NCCc1ccccn1,C52603393_decoy,WEE1,Decoy,0.0,-8.88923,-8.01,-2.9,-8.266352222144661
Cc1ccc(S(=O)(=O)C/[NH+]=C(/NC(=S)NN(c2ccccc2)c2ccccc2)c2ccccc2)cc1,C11852420_decoy,WEE1,Decoy,0.0,-9.1094,-9.5,-4.05,-10.139113798905823
COC(=O)c1ccccc1NC(=S)N(Cc1ccc(N(C)C)cc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59092630_decoy,WEE1,Decoy,0.0,-8.99608,-8.49,-2.81,-9.130251384616674
Cc1ccc(NC(=O)c2cc3cc(C(C)(C)C)cc(O)c3o/c2=[NH+]\NS(=O)(=O)c2ccc(C)cc2)cc1,C59170412_decoy,WEE1,Decoy,0.0,-10.9352,-9.68,-2.51,-9.07177348985374
Cc1c(NC(=O)CSC2=[NH+]C3(CCCCC3)NN2c2ccccc2)c(=O)n(-c2ccccc2)n1C,C59564713_decoy,WEE1,Decoy,0.0,-8.32941,-7.88,-1.53,-7.108809136061321
O=C(C[NH+](Cc1ccccc1)CC1CCC1)Nc1cccc(S(=O)(=O)/N=C2/CCCCCN2)c1,C60044323_decoy,WEE1,Decoy,0.0,-9.54707,-8.22,-0.89,-9.465909865762267
COC(=O)c1ccc(F)c(NC(=O)[C@H](CC2=c3ccccc3=[NH+]C2)NC(=O)OCc2ccccc2)c1,C63152673_decoy,WEE1,Decoy,0.0,-7.45406,-8.87,-3.24,-8.523943227714517
Cc1ccc(C)c(NC(=O)CS[C@@H]2N=N[C@@H]([C@H](CC3=c4ccccc4=[NH+]C3)NC(=O)OC(C)(C)C)O2)c1,C63426751_decoy,WEE1,Decoy,0.0,-8.12926,-9.01,-3.05,-8.41536650060815
CC(C)(C)c1ccc(C(=O)N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)NCCC2=c3ccccc3=[NH+]C2)cc1,C64136959_decoy,WEE1,Decoy,0.0,-7.54841,-9.15,-3.39,-7.284329847500391
COc1cc(/C=N/NC(=S)Nc2cccc(C)c2)ccc1OC(=O)c1cccc(Br)c1,C02543751_decoy,WEE1,Decoy,0.0,-8.5584,-9.93,-1.83,-7.905689095218562
Cc1ccc(S(=O)(=O)N[C@@H](NC(=O)COc2ccc(Cl)cc2C)C(Cl)(Cl)Cl)cc1,C02258993_decoy,WEE1,Decoy,0.0,-10.1766,-9.24,-3.4,-10.78071617310493
O=C(CSc1nnc(NC(=O)CSCc2ccccc2)s1)Nc1cccc(C(F)(F)F)c1,C08823395_decoy,WEE1,Decoy,0.0,-11.3648,-9.88,-2.69,-10.258863652976505
O=C1Nc2cc(C(=O)N3CCN(c4ccc(F)cc4)CC3)ccc2N[C@H]1CSCc1ccc(F)cc1,C09505412_decoy,WEE1,Decoy,0.0,-9.25281,-8.18,-1.44,-9.515168519895106
COc1ccc(CNC(=O)C2CCC(CNS(=O)(=O)c3ccc(Br)s3)CC2)cc1,C09559543_decoy,WEE1,Decoy,0.0,-9.78702,-9.2,-1.14,-8.409312431830115
CC(C)COc1ccc(C(=O)NC(=S)Nc2ccccc2OC[C@H]2CCCO2)cc1Br,C10011336_decoy,WEE1,Decoy,0.0,-9.81511,-7.77,-3.12,-8.55540437183569
Cc1cc(Br)ccc1OCC(=O)NNC(=O)COc1ccc(C(C)C)cc1Br,C12489263_decoy,WEE1,Decoy,0.0,-8.92328,-8.24,-3.43,-7.235966507691874
CCOC(=O)c1c(NC(=S)NC(=O)COc2ccc(C)cc2Br)sc2c1CCCC2,C12498311_decoy,WEE1,Decoy,0.0,-9.41632,-8.29,-1.01,-10.94686471287257
COc1ccc(NC(=O)/C(=C/c2ccc(OC(C)C)cc2)NC(=O)c2cccc(Br)c2)cc1,C12659089_decoy,WEE1,Decoy,0.0,-9.68728,-7.08,-2.89,-7.806182813218532
O=C(NC1CCCCC1)[C@@H](c1ccc(F)cc1)N(Cc1ccco1)C(=O)c1ccc(-c2ccccc2)[nH]1,C12705362_decoy,WEE1,Decoy,0.0,-7.14829,-5.21,-3.81,-4.856683446309964
COC(=O)c1sccc1NC(=O)CSc1ccccc1NC(=O)CSc1ccc(Br)cc1,C12950916_decoy,WEE1,Decoy,0.0,-11.4235,-8.03,-1.86,-10.416697704402738
Cc1ccccc1C(=O)NC(=S)Nc1cc(-c2cc(C)n(-c3ccc(F)cc3)c2C)nn1-c1ccccc1,C03198766_decoy,WEE1,Decoy,0.0,-8.67629,-8.82,-3.83,-6.957068597008892
Cc1ccccc1O[C@H](C)C(=O)NNC(=O)COc1c(C)cc(Br)cc1Br,C13994165_decoy,WEE1,Decoy,0.0,-8.21272,-7.69,-1.1,-9.55649182179521
CCCOc1ccc(Br)cc1C(=O)NNC(=O)COc1ccc(Br)cc1C,C14652776_decoy,WEE1,Decoy,0.0,-9.02817,-7.39,-1.88,-7.349885773179887
COC(=O)c1c(NC(=S)NC(=O)c2ccc(OCC(C)C)c(Br)c2)sc2c1CCC2,C14653746_decoy,WEE1,Decoy,0.0,-11.3715,-8.35,-3.08,-8.795023886963902
CCOC(=O)c1c(NC(=S)NC(=O)c2cc(Br)ccc2OCC)sc2c1CCCC2,C14655308_decoy,WEE1,Decoy,0.0,-10.0531,-8.03,-3.31,-9.66313717976304
Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1cc(Br)ccc1OCC(C)C,C14667004_decoy,WEE1,Decoy,0.0,-9.20472,-7.57,-2.71,-7.0701544066607145
CCOC(=O)c1c(NC(=S)NC(=O)c2cc(Br)ccc2OC(C)C)sc2c1CCC2,C14668386_decoy,WEE1,Decoy,0.0,-9.5972,-8.62,-2.22,-12.103962524664876
COc1c(Br)cc(Br)cc1/C=N/NC(=O)CNC(=O)c1ccc(Cl)cc1,C03113462_decoy,WEE1,Decoy,0.0,-8.99165,-7.63,-3.2,-7.572283167334416
Cc1ccc(S(=O)(=O)N[C@@H](CC(=O)N/N=C/c2ccc(Br)cc2)c2ccccc2)cc1,C15229954_decoy,WEE1,Decoy,0.0,-8.10609,-9.42,-2.47,-8.484889139295218
COc1ccc(/C=C(/C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2)c2ccccc2)cc1,C16215803_decoy,WEE1,Decoy,0.0,-8.25279,-8.57,-5.09,-6.722483498038633
CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cc2)NC(=S)N1C,C16608985_decoy,WEE1,Decoy,0.0,-8.37436,-8.81,-3.77,-7.366329316241406
Cc1cccc(N(C(=O)c2ccc(NC(C)C)nc2)[C@@H](C(=O)NC2CCCC2)c2ccc(F)cc2)c1C,C20150899_decoy,WEE1,Decoy,0.0,-6.81083,-4.45,-4.81,-4.365116683677462
C/C(=N\NC(=O)c1cn(C)c2ccccc12)c1ccc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1,C20159521_decoy,WEE1,Decoy,0.0,-8.1545,-8.68,-2.64,-7.03505434471198
Cc1cccc(NCc2nnc(SCCC(=O)Nc3ccc(C(F)(F)F)cc3)n2-c2ccccc2)c1,C20829096_decoy,WEE1,Decoy,0.0,-7.41274,-8.16,-2.47,-7.195134051431482
COc1cc(CNC[C@H](O)c2ccccc2)cc(Br)c1OCc1ccc2c(c1)OCCO2,C20876915_decoy,WEE1,Decoy,0.0,-9.6075,-8.31,-1.6,-7.081350945572229
Cc1ccc(C(=O)N2CCN(c3c(Cl)cccc3NC(=S)NC(=O)c3cccc(C)c3)CC2)cc1,C30825978_decoy,WEE1,Decoy,0.0,-8.37406,-8.77,-3.86,-8.174319054569771
Cc1ccc(C(=O)NC(=S)Nc2cc(Cl)ccc2N2CCN(C(=O)c3ccccc3F)CC2)cc1,C30826427_decoy,WEE1,Decoy,0.0,-8.97266,-5.27,-0.86,-5.24164101667101
O=C(NC(=S)Nc1ccc(N2CCN(C(=O)C(F)(F)F)CC2)cc1)c1ccc(Cl)c(Cl)c1,C30826958_decoy,WEE1,Decoy,0.0,-9.28539,-7.49,-1.59,-5.696221549443331
CCOC(=O)c1c(NC(=O)CSCC(=O)Nc2ccc(Br)cc2)sc2c1CCCC2,C32692419_decoy,WEE1,Decoy,0.0,-10.3612,-7.93,-2.84,-9.210743374453749
Cc1ccc(-n2c(CNC(=O)Nc3ccc(Br)cc3)nnc2SCc2ccccc2)cc1,C33761422_decoy,WEE1,Decoy,0.0,-8.24104,-6.1,-3.32,-5.457213836383186
CC[C@H](C)[C@H](NC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N1CCN(C/C=C/c2ccccc2)CC1,C34969882_decoy,WEE1,Decoy,0.0,-9.59691,-8.67,-3.4,-5.762826815239638
CC[C@@H](C)[C@@H](NC(=O)Nc1ccccc1Br)C(=O)N1CCN(C/C=C/c2ccccc2)CC1,C34969899_decoy,WEE1,Decoy,0.0,-8.75617,-8.88,-1.64,-6.349628705100008
O=C(Nc1nnc(-c2ccc(Cl)cc2)s1)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]1c1ccccc1,C35723641_decoy,WEE1,Decoy,0.0,-8.52821,-8.29,-3.47,-7.556628735053705
C[C@@H](c1ccccc1)[C@H](C(=O)NC(C)(C)C)N(Cc1ccco1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36502226_decoy,WEE1,Decoy,0.0,-7.64966,-5.94,-2.74,-5.0421913352265415
COc1ccc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(C)C(=O)C(O)(c2ccccc2)c2ccccc2)cc1,C36534717_decoy,WEE1,Decoy,0.0,-6.95833,-7.99,-2.69,-8.056013154341539
CN(C(=O)CNC(=O)c1ccccc1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(C(F)(F)F)cc1,C36536957_decoy,WEE1,Decoy,0.0,-6.91987,-7.67,-3.39,-7.192091520684492
Cc1ccc(C(C)C)c(OCc2nc(C(=O)NCCCNC(=O)c3ccc4ccccc4c3)cs2)c1,C37641527_decoy,WEE1,Decoy,0.0,-8.55665,-10.01,-3.55,-8.266596614156779
Cc1nn(-c2ccccc2)c(N2CCCC2)c1/C=N/NC(=S)Nc1cc(C(F)(F)F)ccc1Cl,C08690872_decoy,WEE1,Decoy,0.0,-8.77321,-8.96,-3.48,-7.846837626227163
Cc1ccc(S(=O)(=O)C/N=C(\NC(=S)NN(c2ccccc2)c2ccccc2)c2ccccc2)cc1,C01877748_decoy,WEE1,Decoy,0.0,-9.49839,-5.3,-1.53,-5.938990751249487
CSc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C(C)(C)C)cc4)ccc32)cc1,C38682486_decoy,WEE1,Decoy,0.0,-10.4961,-9.91,-1.28,-11.330278683346066
CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)C(c4ccccc4)c4ccccc4)ccc32)c1,C38685016_decoy,WEE1,Decoy,0.0,-8.88144,-10.08,-2.07,-7.84585112318523
COc1cc(C(NC(=O)c2ccc(F)cc2)NC(=O)c2ccc(F)cc2)ccc1OCc1ccccc1,C39859556_decoy,WEE1,Decoy,0.0,-7.83565,-7.26,-2.83,-6.017984296549865
O=S(=O)(c1ccc(NC(=S)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1)N1CCCCC1,C39970960_decoy,WEE1,Decoy,0.0,-8.8735,-8.56,-1.64,-9.316968485750726
CCOCCCNC(=O)c1c(NC(=O)c2oc3cc(Br)ccc3c2C)sc2c1CCC2,C40115549_decoy,WEE1,Decoy,0.0,-8.60413,-9.07,-3.56,-9.652298087193238
Cc1ccsc1/C=N/NC(=O)c1cc2n(n1)[C@@H](C(F)(F)C(F)(F)F)C[C@@H](c1ccc(F)cc1)N2,C02782875_decoy,WEE1,Decoy,0.0,-9.23735,-10.46,-1.38,-8.680611972998934
COc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)cc(Br)c1OCc1cccc(C)c1,C58890022_decoy,WEE1,Decoy,0.0,-8.37624,-8.83,-3.11,-8.437387563768718
Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)NC3CCCCC3)cc2)c(C(C)C)cc1Br,C13977493_decoy,WEE1,Decoy,0.0,-9.81881,-10.04,-3.27,-9.236893682080137
CCO[C@@H](NC(=O)c1ccc(Br)cc1)[C@H](NC(=O)c1ccc(Br)cc1)OCC,C59367532_decoy,WEE1,Decoy,0.0,-8.69833,-7.0,-1.71,-9.068947904607624
COc1ccc([C@H]2N[C@@H](C(=O)[O-])CC3=c4ccccc4=[NH+][C@@H]32)cc1CSc1nc2ccccc2s1,C63350041_decoy,WEE1,Decoy,0.0,-8.00969,-9.37,-3.36,-7.87951497739625
COc1ccc([C@H]2C=C(c3cccs3)NN2C(=O)COC(=O)c2ccc(Cl)c(N)c2)cc1OC,C02618592_decoy,WEE1,Decoy,0.0,-10.5626,-8.83,-0.87,-12.52291382868061
COc1cc(/C=N/NC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cc(Br)c1O,C06131406_decoy,WEE1,Decoy,0.0,-10.4638,-8.13,-2.05,-9.763678764674882
CCCCNC(=O)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(OC)c(Br)c2)cc1,C02645362_decoy,WEE1,Decoy,0.0,-9.59248,-8.4,-3.12,-10.025232655445912
COC(=O)c1c(NC(=S)NNC(=O)c2nn(C)c(C)c2Br)sc2c1CC[C@@H](C)C2,C02857383_decoy,WEE1,Decoy,0.0,-9.61476,-8.04,-1.58,-8.961714007881545
NC(=O)c1c(NC(=O)COc2c(-c3ccco3)oc3ccc(Cl)cc3c2=O)sc2c1CCCC2,C09042714_decoy,WEE1,Decoy,0.0,-8.58906,-9.03,-2.81,-7.967389256085277
Cc1ccc(NC(=O)NC(=O)COC(=O)c2cccc(S(=O)(=O)Nc3ccc(F)cc3)c2)c(C)c1,C10279251_decoy,WEE1,Decoy,0.0,-8.8705,-8.63,-3.38,-7.294215982617614
Cc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3cccc([N+](=O)[O-])c3)cc2)cc1C,C10010863_decoy,WEE1,Decoy,0.0,-10.6166,-9.53,-4.82,-9.093019612164069
O=C(COc1ccc2ccccc2c1Br)NC(=S)NNC(=O)c1ccc([N+](=O)[O-])cc1,C12503297_decoy,WEE1,Decoy,0.0,-8.96667,-10.32,-2.05,-11.065479023522345
COc1cc(/C=N/NC(=S)Nc2cccc(Cl)c2)ccc1OCC(=O)Nc1c(C)cc(C)cc1C,C13101844_decoy,WEE1,Decoy,0.0,-8.64467,-8.51,-1.74,-7.085648704825575
COc1cc(NC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2nnc(-c3ccc(F)cc3)s2)cc(OC)c1,C16608357_decoy,WEE1,Decoy,0.0,-8.8783,-7.94,-1.67,-8.881422503106531
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@@H]1c1cccc(NC(=O)Nc2ccc(OC)cc2OC)c1,C16611054_decoy,WEE1,Decoy,0.0,-8.17786,-6.84,-1.85,-7.636646985314565
CCOc1ccc(-c2nnc(SCC(=O)N[C@@H](c3ccc4c(c3)OCCCO4)C(C)C)n2N)cc1,C19352324_decoy,WEE1,Decoy,0.0,-9.67348,-9.52,-1.57,-8.930192313425282
COc1ccccc1NC(=O)C1=C(C)NC(SCC(=O)Nc2nccs2)=C(C#N)[C@H]1c1ccccc1,C08743948_decoy,WEE1,Decoy,0.0,-10.7701,-8.41,-1.47,-17.02061276559028
C=CCOC(=O)C1=C(C)NC(SCC(=O)Nc2ccc(C)cc2)=C(C#N)[C@H]1c1ccc(O)c(OC)c1,C20101738_decoy,WEE1,Decoy,0.0,-9.00234,-8.84,-4.35,-8.578370534426941
C=CCOC(=O)C1=C(C)NC(SCC(=O)Nc2ccc(C)cc2)=C(C#N)[C@@H]1c1ccc(O)c(OC)c1,C20101741_decoy,WEE1,Decoy,0.0,-8.1139,-7.24,-1.41,-6.358698700011763
CCOC(=O)c1ccc(NC(=O)C2=C(C)NC(SCC(=O)NC(C)(C)C)=C(C#N)[C@H]2c2ccco2)cc1,C09012063_decoy,WEE1,Decoy,0.0,-8.01726,-5.05,-3.63,-5.273253854697903
CC[C@H](C)Sc1nnc(NC(=O)CSc2n[nH]c(N/N=C/c3ccc(Cl)cc3Cl)n2)s1,C21076856_decoy,WEE1,Decoy,0.0,-10.702,-7.9,-1.23,-12.406603365145468
COc1ccccc1NC(=O)C1=C(C)NC(SCC(=O)Nc2ccccc2)=C(C#N)[C@H]1c1ccoc1,C13018473_decoy,WEE1,Decoy,0.0,-9.45197,-9.03,-1.88,-11.5258707373417
CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(CNc2cccc(C(F)(F)F)c2)n1C1CCCCC1,C22381421_decoy,WEE1,Decoy,0.0,-7.65319,-8.91,-3.87,-8.4356943213972
CC[C@@H](Sc1cc(-c2ccccc2)nc(C)n1)C(=O)Nc1nc2ccc(S(N)(=O)=O)cc2s1,C32535448_decoy,WEE1,Decoy,0.0,-9.70177,-7.64,-2.25,-7.337224526364292
O=C(NCCCNc1ccc(C(F)(F)F)cn1)c1cccc(S(=O)(=O)Nc2ccccc2F)c1,C32911947_decoy,WEE1,Decoy,0.0,-7.66313,-7.24,-3.17,-5.895161814170072
CC(C)NC(=O)C[NH+]1CCN(c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)c(C(=O)[O-])c2)CC1,C33006930_decoy,WEE1,Decoy,0.0,-8.68329,-8.97,-3.97,-11.51204502276998
Cc1cnc(NC(=O)CSc2nc([C@@H](NC(=O)c3ccc(Cl)cc3Cl)C(C)C)n[nH]2)s1,C02143718_decoy,WEE1,Decoy,0.0,-9.5375,-8.58,-2.52,-8.938061570511982
CCOC(=O)c1c(NC(=O)COC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)sc(C(=O)NC)c1C,C36188741_decoy,WEE1,Decoy,0.0,-10.2932,-8.62,-2.73,-10.112366449312466
CC[C@@H](C)NC(=O)[C@@H](NC(=O)c1ccc2c(c1)OCO2)C1CCN(C(=O)Nc2cccc(Cl)c2)CC1,C36214354_decoy,WEE1,Decoy,0.0,-8.84321,-7.55,-3.99,-7.244754811346577
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)CNC(=O)N[C@@H](C)[C@@H]1C[C@H]2CC[C@@H]1C2,C36413020_decoy,WEE1,Decoy,0.0,-9.04641,-8.92,-2.02,-10.259434481723517
Cc1ccc(CN(C(=O)C(O)(c2ccccc2)c2ccccc2)[C@H](C(=O)NC(C)(C)C)c2ccccc2O)o1,C36599008_decoy,WEE1,Decoy,0.0,-7.21547,-3.5,-4.05,-4.873127695210218
Cc1cc2nc(-c3ccc(SCC(=O)Nc4ccc(S(=O)(=O)NC5CC5)cc4)nc3)[nH]c2cc1C,C08829070_decoy,WEE1,Decoy,0.0,-9.71609,-9.31,-2.68,-8.052039746994296
CC(C)(C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c(Br)c1,C02866159_decoy,WEE1,Decoy,0.0,-9.36775,-8.77,-1.1,-9.594235504495629
Cc1cc(NC(=O)CS[C@@H]2N=N[C@@H]([C@@H]3C=C(c4ccc(F)cc4)N=N3)N2N)ccc1Br,C39592692_decoy,WEE1,Decoy,0.0,-9.64714,-6.15,-2.24,-6.226273945866976
COc1ccc(C2=C[C@@H]([C@@H]3N=N[C@H](SCC(=O)Nc4ccc(Br)c(C)c4)N3N)N=N2)cc1,C39593972_decoy,WEE1,Decoy,0.0,-9.05871,-9.25,-2.51,-7.834076201345258
Cc1ccc(NC(=O)[C@@H](C)Sc2nnc([C@H](CO)NC(=O)c3ccccc3F)n2-c2ccccc2)cc1,C39749575_decoy,WEE1,Decoy,0.0,-9.11873,-9.12,-2.76,-8.612536136202555
Cc1cccc(C(=O)N[C@@H](CO)c2nnc(SCC(=O)Nc3ccccc3C(C)C)n2-c2ccccc2)c1,C39767639_decoy,WEE1,Decoy,0.0,-9.60073,-7.45,-4.13,-7.285816289577584
CCOC(=O)c1c(NC(=O)[C@H](CC)n2c(N)nnc2SCc2ccccc2)sc2c1CCCC2,C40172995_decoy,WEE1,Decoy,0.0,-9.27339,-8.9,-3.08,-9.006309198241208
CC(C)(C)[C@@H]1CCc2c(sc(NC[C@H](O)COc3ccccc3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C40312458_decoy,WEE1,Decoy,0.0,-10.8329,-8.89,-3.51,-8.818924180304672
CC(C)(C)[C@@H]1CCc2c(sc(NC[C@H](O)COc3ccccc3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C40312465_decoy,WEE1,Decoy,0.0,-12.12,-8.47,-3.49,-10.026311094985552
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@@H]1c1cccc(NC(=O)Nc2cc(OC)cc(OC)c2)c1,C40367700_decoy,WEE1,Decoy,0.0,-9.08237,-7.29,-3.4,-6.918114769609367
CCNC(=O)c1cccc(NC(=O)CSc2nnc(Nc3ccc(SC(F)F)cc3)s2)c1,C45446827_decoy,WEE1,Decoy,0.0,-8.58979,-7.19,-1.08,-6.824915713082364
COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=S)Nc3ccc(C)c(C)c3)c2)cc1,C46772222_decoy,WEE1,Decoy,0.0,-8.97477,-9.24,-1.81,-7.534379995234977
COc1cc(NC(=S)N[C@H]2CO[C@H]3[C@@H]2OC[C@H]3OC(=O)Nc2cccc3ccccc23)cc(OC)c1,C03841732_decoy,WEE1,Decoy,0.0,-8.09972,-9.02,-4.39,-8.107588621621113
CC(C)C(=O)N1CCCc2ccc(NC(=O)C(=O)NCC3CCN(C(=O)Nc4ccc(F)cc4)CC3)cc21,C49523826_decoy,WEE1,Decoy,0.0,-8.27315,-7.91,-2.96,-6.019248201202158
C=CCSc1ccccc1NC(=O)CSc1n[nH]c(N/N=C/c2cccc(Br)c2)n1,C58994039_decoy,WEE1,Decoy,0.0,-10.2733,-7.4,-2.33,-9.109870198941936
Cc1ccc(/C=N/Nc2nc(SCC(=O)Nc3nnc(SCc4ccccc4)s3)n[nH]2)cc1,C59019557_decoy,WEE1,Decoy,0.0,-10.9385,-8.4,-0.98,-8.678144335918264
C/C(=N/Nc1nc(SCC(=O)Nc2sc3c(c2C#N)CCC3)n[nH]1)c1ccc(Br)cc1,C59020902_decoy,WEE1,Decoy,0.0,-9.82857,-8.54,-2.59,-8.425187175084893
COc1cccc(CNC(=O)CSc2n[nH]c(N/N=C(\C)C34CC5CC(CC(C5)C3)C4)n2)c1OC,C59310684_decoy,WEE1,Decoy,0.0,-10.4048,-8.3,-1.26,-9.734206217600908
COc1cc(C(=O)NC(=S)Nc2ccc(NC(=O)c3cc4ccccc4o3)c(C)c2)cc(OC)c1OC,C59331397_decoy,WEE1,Decoy,0.0,-10.4042,-9.29,-2.1,-7.931133263268194
CCN(CC)C(=O)c1ccc(NCC(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1,C66083190_decoy,WEE1,Decoy,0.0,-8.60741,-9.4,-1.35,-7.380400332718182
CCN(C(=O)c1ccc(NC(=O)CNc2cccc(C(=O)NCc3ccco3)c2)cc1)c1ccccc1,C66086182_decoy,WEE1,Decoy,0.0,-8.76749,-7.5,-4.11,-6.229901694732491
CCN(C(=O)c1ccc(NC(=O)CNc2cccc(C(=O)NC[C@H]3CCCO3)c2)cc1)c1ccccc1,C66087204_decoy,WEE1,Decoy,0.0,-9.51389,-8.12,-3.4,-7.721592969213709
C[C@H](NC(=O)c1cccc(NC(=O)CNc2cccc(C(=O)N(C)Cc3ccccc3)c2)c1)c1ccccc1,C66096428_decoy,WEE1,Decoy,0.0,-8.07806,-10.2,-3.81,-10.998580024343632
C[NH+]1CCN(S(=O)(=O)c2ccc(NC(=S)NC(=O)/C=C/c3cccc4ccccc34)cc2)CC1,C08442676_decoy,WEE1,Decoy,0.0,-9.79751,-8.55,-1.15,-8.143542445153034
CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)[NH+]2CCC(c3nc4ccccc4s3)CC2)cc1,C09634070_decoy,WEE1,Decoy,0.0,-10.0643,-7.04,-1.38,-7.763220363211297
C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)[NH+]1CCC(NS(=O)(=O)c2cccs2)CC1,C11719922_decoy,WEE1,Decoy,0.0,-10.7482,-8.35,-3.07,-9.593243132868103
O=C(NCc1ccc2c(c1)OCO2)c1cc2cc(C3(O)CC[NH+](C[C@H]4CC=CCC4)CC3)ccc2o1,C11812975_decoy,WEE1,Decoy,0.0,-10.7705,-7.52,-2.43,-6.250230943523507
O=C(Cc1ccc(N2CCC([NH2+]CC[C@H]3COc4ccccc4O3)CC2)cc1)NCc1ccccc1,C14971492_decoy,WEE1,Decoy,0.0,-10.0293,-8.01,-3.76,-7.754760181197981
O=C(Cc1ccc(N2CCC([NH2+]Cc3cnn(-c4ccc(F)cc4)c3)CC2)cc1)NCc1ccccc1,C14975631_decoy,WEE1,Decoy,0.0,-9.74473,-5.95,-2.56,-4.827460528524395
COc1cc(CN(Cc2ccccc2)C(=S)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc(OC)c1OC,C21262960_decoy,WEE1,Decoy,0.0,-8.94815,-7.88,-3.46,-8.517423859574063
COc1cc(OC)c(OC)cc1CN(Cc1cccnc1)C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C21263705_decoy,WEE1,Decoy,0.0,-8.46972,-7.08,-2.62,-7.179525807869184
O=C(NCCc1ccc2c(c1)OCO2)[C@@H]1C[C@@H](NCc2ccc(Cl)cc2)C[NH+]1Cc1ccccc1,C32520428_decoy,WEE1,Decoy,0.0,-8.4947,-9.38,-2.98,-8.869995732958863
CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccccn2)N2NC(SCc3ccccc3F)=NC2=[NH+]1,C08591648_decoy,WEE1,Decoy,0.0,-8.08006,-5.7,-2.08,-6.438634489730386
COc1ccccc1NC(=O)C(=O)N[C@H](C)[C@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1,C38596782_decoy,WEE1,Decoy,0.0,-7.87302,-8.27,-2.87,-8.123847816981867
CCOc1ccccc1NC(=O)C(=O)N[C@@H](C)[C@@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1,C38596951_decoy,WEE1,Decoy,0.0,-7.77743,-7.76,-3.28,-8.859187474607875
C[C@@H](CNC(=O)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2)Oc1ccc(F)cc1,C39596408_decoy,WEE1,Decoy,0.0,-9.47154,-9.05,-2.39,-8.686897812513267
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCc3ccc(OC(F)(F)F)cc3)C3(CC[NH2+]CC3)C2)cc1C,C39599847_decoy,WEE1,Decoy,0.0,-7.73038,-10.79,-3.28,-8.424147074177162
CC(C)[C@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCc2ccc(OC(F)(F)F)cc2)C2(CC[NH2+]CC2)C1,C39599963_decoy,WEE1,Decoy,0.0,-8.33744,-7.0,-1.71,-6.127527176961458
C[C@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCc2cc(F)cc(C(F)(F)F)c2)C2(CC[NH2+]CC2)C1,C39600350_decoy,WEE1,Decoy,0.0,-7.2886,-9.06,-2.6,-7.635968804780821
O=C(N[C@@H]1CCC[C@H]1OCc1ccccc1)[C@@H]1CN(C(=O)c2ccc3ccccc3n2)CC12CC[NH2+]CC2,C39609124_decoy,WEE1,Decoy,0.0,-8.96304,-9.22,-0.66,-8.15162993206141
CCOc1cccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(OC)c(C(F)(F)F)c3)CC23CC[NH2+]CC3)c1,C39609545_decoy,WEE1,Decoy,0.0,-9.13985,-9.74,-3.87,-9.40963349133396
COc1ccccc1CCNC(=O)[C@H]1CN(C(=O)c2cccnc2Sc2ccccc2)CC12CC[NH2+]CC2,C39636366_decoy,WEE1,Decoy,0.0,-9.36096,-7.64,-3.13,-6.663996678712142
O=C(NCc1cccc(C(F)(F)F)c1)[C@@H]1CN(C(=O)COc2cccc(Cl)c2)CC12CC[NH2+]CC2,C39636817_decoy,WEE1,Decoy,0.0,-8.77962,-8.13,-3.1,-7.561814818682414
COc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3cccc(F)c3)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C39637720_decoy,WEE1,Decoy,0.0,-8.49064,-10.3,-3.06,-9.392531062518351
COc1ccc(C(=O)N2C[C@H](C(=O)NCCc3ccc(Br)cc3)C3(CC[NH2+]CC3)C2)c(OC)c1,C39652862_decoy,WEE1,Decoy,0.0,-9.53361,-6.13,-2.38,-5.523334505075005
C[C@H](CNC(=O)[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CC12CC[NH2+]CC2)Oc1ccccc1,C39665044_decoy,WEE1,Decoy,0.0,-7.83392,-9.05,-2.49,-8.461422134055127
C[C@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665113_decoy,WEE1,Decoy,0.0,-8.66406,-8.27,-2.17,-7.390547562795817
CC[C@H](C(=O)N1C[C@H](C(=O)NC[C@@H](C)Oc2ccc(OC)cc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39665744_decoy,WEE1,Decoy,0.0,-8.14952,-8.22,-2.88,-6.706199939154554
COc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)c3csc4ccccc34)CC23CC[NH2+]CC3)cc1,C39665806_decoy,WEE1,Decoy,0.0,-10.1408,-7.66,-1.45,-8.150311970579036
Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)cc1,C39665956_decoy,WEE1,Decoy,0.0,-8.05234,-5.26,-4.03,-5.794547273461363
Cc1ccc(O[C@H](C)CNC(=O)[C@H]2CN(C(=O)c3cc(C)nn3C(C)(C)C)CC23CC[NH2+]CC3)cc1,C39666195_decoy,WEE1,Decoy,0.0,-8.20797,-5.85,-2.45,-5.919367279373751
C[C@@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)Oc1cccnc1,C39668752_decoy,WEE1,Decoy,0.0,-9.54986,-7.12,-3.04,-6.650023672318887
CC[C@H](C(=O)N1C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)C2(CC[NH2+]CC2)C1)c1ccccc1,C39672238_decoy,WEE1,Decoy,0.0,-9.6696,-9.35,-2.55,-9.794036459956285
COc1ccc(C(=O)N2C[C@H](C(=O)NCc3ccc(C)c(C)c3)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C39673137_decoy,WEE1,Decoy,0.0,-9.81736,-8.95,-2.57,-9.0656519688903
O=C(NCc1ccc(OC(F)F)cc1)[C@@H]1CN(C(=O)c2ccc3ccccc3c2)CC12CC[NH2+]CC2,C39673271_decoy,WEE1,Decoy,0.0,-8.53503,-6.12,-4.25,-5.982361983307289
O=C(NCc1ccc(OC(F)F)cc1)[C@H]1CN(C(=O)c2cccc(Br)c2)CC12CC[NH2+]CC2,C39673276_decoy,WEE1,Decoy,0.0,-8.58796,-9.79,-2.97,-8.600745617709437
O=C(NCc1ccc(OC(F)F)cc1)[C@@H]1CN(C(=O)c2cccc(Br)c2)CC12CC[NH2+]CC2,C39673277_decoy,WEE1,Decoy,0.0,-8.78335,-8.12,-3.51,-7.680576889098398
CCOc1ccc(C(=O)N2C[C@H](C(=O)N[C@H](C)CCc3ccc(OC)cc3)C3(CC[NH2+]CC3)C2)cc1,C39675240_decoy,WEE1,Decoy,0.0,-9.75416,-9.35,-2.17,-9.05048625759708
CC[C@@H](C(=O)N1C[C@H](C(=O)NCc2cnn(Cc3ccccc3)c2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39676077_decoy,WEE1,Decoy,0.0,-9.33361,-8.16,-3.19,-8.143692692744098
COc1ccc(C(NC(=O)[C@H]2CN(C(=O)CCSC)CC23CC[NH2+]CC3)c2ccc(OC)cc2)cc1,C39676577_decoy,WEE1,Decoy,0.0,-10.6622,-8.53,-3.16,-10.748704891120244
CC[C@H](C(=O)N1C[C@H](C(=O)NCc2ccc(-c3ccccn3)s2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39677690_decoy,WEE1,Decoy,0.0,-8.49782,-6.75,-4.02,-6.504455799064589
CC(C)COCCCNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2,C39683345_decoy,WEE1,Decoy,0.0,-8.88095,-6.17,-3.14,-6.684596775868259
O=C(NCCOc1ccccc1F)[C@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39685066_decoy,WEE1,Decoy,0.0,-7.88027,-8.69,-5.19,-10.58622371117206
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(OC)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39686643_decoy,WEE1,Decoy,0.0,-7.51633,-9.92,-3.01,-7.991003627013193
CCC(CC)C(=O)N1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCCC2)C2(CC[NH2+]CC2)C1,C39687269_decoy,WEE1,Decoy,0.0,-9.13754,-7.5,-4.34,-5.077612661982197
O=C(NCCOc1ccc(F)cc1)[C@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39688190_decoy,WEE1,Decoy,0.0,-7.16228,-9.6,-1.73,-8.679310630616106
CCC[C@@H](CNC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)c1ccc(Cl)cc1Cl,C39946110_decoy,WEE1,Decoy,0.0,-11.108,-9.1,-3.97,-9.551107373290586
COc1ccc(NC(=O)CSC2=NN[C@H](CC3=c4ccccc4=[NH+]C3)N2Cc2ccccc2)cc1,C63323716_decoy,WEE1,Decoy,0.0,-8.84976,-9.35,-2.07,-11.838528935713324
CC[C@@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CC2=c3ccccc3=[NH+][C@H]2[C@H]2c3ccccc3C(=O)N21,C63384343_decoy,WEE1,Decoy,0.0,-9.0451,-4.81,-2.8,-6.381549617845892
CC(C)NC(=O)[C@H](CC1=c2ccccc2=[NH+]C1)NC(=O)[C@H]1N2C(=O)c3ccccc3[C@H]2SC1(C)C,C63480170_decoy,WEE1,Decoy,0.0,-8.78422,-9.25,-2.23,-9.033081693939634
O=C(COC(=O)[C@@H]1[NH+]=c2ccc(Br)cc2=C1Cl)NC(=O)NCCc1cccs1,C64104269_decoy,WEE1,Decoy,0.0,-9.73636,-7.74,-3.2,-7.834743009359381
C=CCNS(=O)(=O)c1cccc(C(=O)NC[C@H](C2=c3ccccc3=[NH+]C2)c2ccc(OC)cc2)c1,C64169865_decoy,WEE1,Decoy,0.0,-7.62782,-9.86,-2.09,-8.303873558184447
COc1ccc(CNC2=[NH+]CCNC23CCN(S(=O)(=O)c2ccc(CC(C)C)cc2)CC3)cc1,C65074858_decoy,WEE1,Decoy,0.0,-8.91242,-5.22,-1.44,-5.075410228962776
Cc1cc(NS(=O)(=O)c2ccc(NC(=O)CSc3nnc(C4CCCCC4)n3N)cc2)nc(C)n1,C02865615_decoy,WEE1,Decoy,0.0,-9.88433,-9.25,-1.71,-9.30386082999108
CCC(C)(C)NC(=O)[C@@H](c1ccc(OC)cc1)N(Cc1ccco1)C(=O)c1snc(C(N)=O)c1N,C06462075_decoy,WEE1,Decoy,0.0,-8.10907,-6.16,-1.64,-6.343235349676307
CCC(C)(C)NC(=O)[C@@H](c1ccc(C)o1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc2c(c1)OCO2,C06462137_decoy,WEE1,Decoy,0.0,-7.33315,-7.47,-1.97,-7.159188411445076
CCC(C)(C)NC(=O)[C@H](c1ccc(F)cc1)N(Cc1ccccc1OC)C(=O)c1snc(C(N)=O)c1N,C06462170_decoy,WEE1,Decoy,0.0,-7.41457,-7.16,-3.28,-8.000551109967486
CCOC(=O)CNC(=O)[C@@H](c1cccs1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1,C06546860_decoy,WEE1,Decoy,0.0,-8.4819,-4.69,-3.53,-4.584994976044454
CCOc1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)C2CCCC2)cc1,C06601703_decoy,WEE1,Decoy,0.0,-8.73661,-4.95,-1.11,-6.460941239138134
COc1ccc(C(=O)N[C@H](NC(=S)Nc2cccc(NC(C)=O)c2)C(Cl)(Cl)Cl)cc1OC,C08858767_decoy,WEE1,Decoy,0.0,-10.4733,-7.29,-3.02,-9.186041783234185
Cc1ccc(NC(=O)CNC(=O)C2CCN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)CC2)cc1,C09013063_decoy,WEE1,Decoy,0.0,-7.81224,-9.06,-2.07,-6.541216522481926
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NNC(=O)c2ccccc2)S(=O)(=O)c2ccc(F)cc2)cc1,C09080737_decoy,WEE1,Decoy,0.0,-7.1054,-7.23,-6.44,-6.226646910385999
O=C(NC[C@@H](c1cccs1)S(=O)(=O)c1ccc2c(c1)OCO2)C(=O)NNC(=O)c1ccccc1,C09103489_decoy,WEE1,Decoy,0.0,-9.65692,-7.57,-4.78,-8.302193159071345
CC(C)c1ccc(S(=O)(=O)[C@H](CNC(=O)C(=O)NNC(=O)c2cccs2)c2cccs2)cc1,C09105146_decoy,WEE1,Decoy,0.0,-10.8256,-6.53,-3.02,-7.442104725341193
CC(C)c1ccc(S(=O)(=O)[C@@H](CNC(=O)C(=O)NNC(=O)c2cccnc2)c2cccs2)cc1,C09105157_decoy,WEE1,Decoy,0.0,-9.2765,-7.53,-2.8,-7.992593745095795
COC(=O)c1ccc(NC(=O)CSc2nnc(NC(=O)Nc3ccc(OC)c(OC)c3)s2)cc1,C09324800_decoy,WEE1,Decoy,0.0,-8.90275,-8.38,-2.03,-7.1258358945869125
COC(=O)N1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4CCC(C)CC4)cc3)c2C(N)=O)C1,C09325319_decoy,WEE1,Decoy,0.0,-9.72798,-11.07,-1.87,-8.45993895380223
CCOC(=O)N1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N(CC)CC)cc3)c2C(N)=O)C1,C04177830_decoy,WEE1,Decoy,0.0,-10.339,-9.61,-0.99,-9.217304691013124
NC(=O)c1nsc(C(=O)N(c2ccc(F)cc2)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(F)cc2)c1N,C12473346_decoy,WEE1,Decoy,0.0,-6.88294,-5.64,-2.48,-5.942501017700402
COc1ccc(CN(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC(C)(C)C)c2ccc(C)cc2)cc1,C12476928_decoy,WEE1,Decoy,0.0,-8.24955,-4.41,-1.55,-5.942336992826388
Cc1ccc(NC(=S)NNC(=S)N=P(N2CCOCC2)(N2CCOCC2)C(C)(C)C)cc1,C12589556_decoy,WEE1,Decoy,0.0,-7.6603,-4.94,-4.75,-4.540235323074087
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@H](C(=O)NC2CCCC2)c2ccc(Cl)cc2)c1N,C12702389_decoy,WEE1,Decoy,0.0,-7.83247,-4.58,-3.23,-4.983107979070975
Cc1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1,C12706206_decoy,WEE1,Decoy,0.0,-8.64618,-4.88,-1.29,-5.621206708872683
COc1ccc(C)cc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC1CCCC1)c1ccc(C)o1,C12714652_decoy,WEE1,Decoy,0.0,-8.69555,-5.05,-2.98,-6.797874813205552
NC(=O)c1nsc(C(=O)N(Cc2ccco2)[C@@H](C(=O)NC2CCCC2)c2ccc3ncccc3c2)c1N,C06445466_decoy,WEE1,Decoy,0.0,-8.55632,-5.62,-3.57,-6.717796469027309
Cc1cc(C)c(NC(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(Cl)c(Cl)c2)[C@@H](C)O)c(C)c1,C13129018_decoy,WEE1,Decoy,0.0,-8.70356,-7.34,-4.09,-7.79386615912456
Cc1ccc(C(=O)NC(=S)NNC(=O)CNC(=O)C2CCCCC2)cc1I,C13985481_decoy,WEE1,Decoy,0.0,-9.85405,-8.36,-3.55,-6.017455548294396
COc1ccc(-c2n[nH]c3c2[C@H](c2cc(OC)c(OC(=O)c4ccco4)c(OC)c2)C(C#N)=C(N)O3)cc1,C08567382_decoy,WEE1,Decoy,0.0,-8.06553,-5.09,-1.46,-5.415280271793489
COc1cccc(OCc2nnc(SCC(=O)N[C@H](c3ccc4c(c3)OCCO4)C(C)C)n2N)c1,C19353847_decoy,WEE1,Decoy,0.0,-9.78117,-8.62,-3.4,-8.709664863320612
COc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(NC(C)=O)cc3)C2)c(OC)cc1NC(=O)c1ccccc1,C20371094_decoy,WEE1,Decoy,0.0,-8.41964,-8.9,-3.27,-6.7893664670410905
Cc1ccc(/C=N/Nc2nc(SCC(=O)Nc3ccc(S(=O)(=O)N4CCC[C@H](C)C4)cc3)n[nH]2)o1,C20834975_decoy,WEE1,Decoy,0.0,-10.0488,-9.19,-2.68,-9.119350388284822
COc1cccc(/C=N/Nc2nnc(SCC(=O)Nc3sc4c(c3C#N)CCCC4)n2N)c1O,C21319113_decoy,WEE1,Decoy,0.0,-8.47661,-8.31,-3.3,-6.579510824560924
COc1ccc(NC(=O)CSc2nnc(N/N=C(\C)c3ccc(Br)cc3)n2N)c(OC)c1,C21323028_decoy,WEE1,Decoy,0.0,-8.53443,-7.57,-1.98,-7.915347503715065
COc1ccc(-c2nnc(SCC(=O)N[C@H](c3ccc4c(c3)OCCO4)C(C)C)n2N)cc1OC,C24143723_decoy,WEE1,Decoy,0.0,-9.7014,-9.07,-1.54,-8.894956534894202
CC(C)[C@H](NC(=O)c1cnccc1C(=O)Nc1ccc2c(c1)OCO2)C(=O)Nc1ccc2c(c1)OCO2,C30822659_decoy,WEE1,Decoy,0.0,-8.42818,-9.2,-3.03,-8.816146806800566
CCCCn1c(N)c(N(CC(C)C)C(=O)CN2C(=O)NC3(CCC(C(C)(C)CC)CC3)C2=O)c(=O)[nH]c1=O,C32957704_decoy,WEE1,Decoy,0.0,-8.2171,-5.56,-2.53,-5.312477006145383
C[C@H](O)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2cccc(Oc3cccc(C(F)(F)F)c3)c2)[C@H]2C(=O)N(C(C)(C)C)C(=O)[C@@H]21,C33628107_decoy,WEE1,Decoy,0.0,-8.40451,-6.32,-2.86,-5.708879336518183
CC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc3C2)cc1,C36022663_decoy,WEE1,Decoy,0.0,-8.29639,-8.45,-3.45,-7.494834319685284
O=C(N[C@@H](C(=O)NC1CC1)C1CCN(C(=S)Nc2ccc(F)cc2)CC1)c1ccc2c(c1)OCO2,C36214563_decoy,WEE1,Decoy,0.0,-8.46973,-8.93,-3.56,-7.93734801398773
NC(=O)c1ccc(S(=O)(=O)N2CCN(CC(=O)N[C@H](c3ccccc3)c3cccs3)CC2)cc1,C12973815_decoy,WEE1,Decoy,0.0,-9.17772,-7.44,-4.19,-7.471693105671355
Cc1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)o1,C12715061_decoy,WEE1,Decoy,0.0,-8.37511,-4.78,-2.59,-5.664842451602057
Cc1cc(C)cc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(C)o2)c1,C12714943_decoy,WEE1,Decoy,0.0,-7.48777,-4.75,-1.64,-5.643450419080648
NC(=O)c1nsc(C(=O)N(c2cccc(F)c2)[C@H](C(=O)NC[C@@H]2CCCO2)c2cccs2)c1N,C12711332_decoy,WEE1,Decoy,0.0,-7.98031,-4.97,-2.35,-6.237911172218815
COc1ccc([C@H](C(=O)NC2CCCC2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1OC,C12716783_decoy,WEE1,Decoy,0.0,-8.1566,-4.66,-1.93,-5.669347962169487
COc1ccc([C@@H](C(=O)NC2CCCC2)N(Cc2ccco2)C(=O)c2snc(C(N)=O)c2N)cc1OC,C12716786_decoy,WEE1,Decoy,0.0,-8.69541,-5.51,-2.47,-6.733490508396854
CCCn1c(N)c(N(CCOC)C(=O)c2ccc(N(C)S(=O)(=O)c3ccc(C)cc3)cc2)c(=O)[nH]c1=O,C12937388_decoy,WEE1,Decoy,0.0,-8.11843,-5.39,-1.9,-4.667352573013068
CCc1nnc(NC(=O)CS[C@@H]2N=N[C@@H](Cc3cc(=O)[nH]c(=O)[nH]3)N2c2cc(C)ccc2C)s1,C39361905_decoy,WEE1,Decoy,0.0,-8.15982,-8.89,-1.86,-9.89935844258647
CCn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1[C@H](CO)NC(=O)c1ccc(OC)cc1,C39759978_decoy,WEE1,Decoy,0.0,-8.41159,-7.97,-2.94,-6.683167225004602
CC(C)Cn1c(S[C@@H](C)C(=O)/N=C2/NCCS2)nnc1[C@@H](CO)NC(=O)c1ccc(Cl)cc1,C39773080_decoy,WEE1,Decoy,0.0,-10.2445,-8.07,-2.84,-9.758587643716943
NS(=O)(=O)c1ccc(CCNC(=O)[C@@H]2CCCN(c3ccc(-c4noc(C5CC5)n4)cc3F)C2)cc1,C40893801_decoy,WEE1,Decoy,0.0,-10.2391,-8.82,-2.72,-8.710598334842262
C#CCN(C)C(=O)C[C@@H]1c2nc(NC(=O)c3ccc(F)cc3)sc2C[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]21C,C43553351_decoy,WEE1,Decoy,0.0,-10.2678,-9.33,-4.51,-8.248758254657021
CC(=O)NNC(=O)c1ccsc1NC(=O)c1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1,C44453249_decoy,WEE1,Decoy,0.0,-10.2261,-6.69,-2.31,-8.124279567340361
COc1ccc(-c2noc(-c3c(SC)nn(CC(=O)Nc4cccc(SC)c4)c3N)n2)cc1OC,C46914827_decoy,WEE1,Decoy,0.0,-10.354,-7.92,-1.94,-7.915687906857128
C=CCn1c(SCC(=O)c2ccc(Br)cc2)nnc1[C@@H](CO)NC(=O)c1ccccc1,C01063542_decoy,WEE1,Decoy,0.0,-8.05323,-8.09,-3.11,-8.427574144911999
C=CCn1c(CNC(=O)c2ccc(Cl)cc2)nnc1SCC(=O)Nc1cccc(C(F)(F)F)c1,C02862001_decoy,WEE1,Decoy,0.0,-7.68751,-9.57,-1.66,-7.782498770388318
COc1ccc(NC(=O)c2nn3c(c2Br)N[C@H](c2ccc(Br)o2)C[C@H]3C(F)(F)F)cc1OC,C00675116_decoy,WEE1,Decoy,0.0,-8.42498,-8.72,-1.34,-6.895568226750823
CC(=O)c1cccc(NC(=O)CSc2nnc(CNc3cccc(C(F)(F)F)c3)n2-c2ccccc2)c1,C00648228_decoy,WEE1,Decoy,0.0,-7.829,-8.84,-4.2,-8.006119049518983
CN(C)c1ccc(NC(=O)C(C)(C)N(Cc2ccccc2F)C(=O)CN2C[C@H](c3ccccc3)NC2=S)cc1,C08695872_decoy,WEE1,Decoy,0.0,-8.80021,-8.38,-1.99,-10.02235269434658
CN(C)c1ccc(NC(=O)C2(N(Cc3ccccc3)C(=O)CN3C[C@H](c4ccccc4)NC3=S)CCSCC2)cc1,C08695948_decoy,WEE1,Decoy,0.0,-9.04523,-10.01,-3.92,-10.346773704077426
CC(=O)Nc1cccc(CN(Cc2cccc(NC(C)=O)c2)S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1,C04106966_decoy,WEE1,Decoy,0.0,-9.50849,-9.81,-4.36,-10.572253488203796
O=C(CCl)Nc1nnc(SCC(=O)Nc2ncc(Br)cc2Br)s1,C08854200_decoy,WEE1,Decoy,0.0,-10.2426,-7.0,-1.89,-8.358727325883914
Cc1cccc(N2C[C@H](C(=O)Nc3nnc(SCC(=O)Nc4ccc(F)cc4F)s3)CC2=O)c1,C08905628_decoy,WEE1,Decoy,0.0,-9.62446,-7.52,-2.6,-5.82716630621348
COc1ccc(C(=O)Nc2ccc3nc(SCC(=O)Nc4c(C)cccc4C)sc3c2)cc1OC,C10042285_decoy,WEE1,Decoy,0.0,-10.657,-7.98,-3.36,-7.257219826023897
Cc1ccc(CN(C(=O)CNC(=O)c2cccs2)[C@@H](C(=O)NCc2ccco2)c2ccc(C)cc2)cc1,C12485510_decoy,WEE1,Decoy,0.0,-7.86661,-7.18,-4.25,-7.760043211157837
Cc1ccc(CN(C(=O)CNC(=O)c2cccs2)[C@H](C(=O)NCc2ccco2)c2ccc(C)cc2)cc1,C12485521_decoy,WEE1,Decoy,0.0,-8.71656,-8.23,-4.22,-8.086928975451134
O=C(NCC(=O)N(c1ccccc1F)[C@H](C(=O)NCc1ccco1)c1ccccc1F)c1cccs1,C12487749_decoy,WEE1,Decoy,0.0,-8.66076,-5.76,-3.1,-7.14745444681706
Cc1ccc([C@@H](C(=O)NCc2ccco2)N(C(=O)CNC(=O)c2cccs2)c2ccc(F)cc2)cc1,C12487922_decoy,WEE1,Decoy,0.0,-8.48165,-6.31,-3.7,-6.600768001185823
Cc1ccc([C@H](O)CNC(=O)CCC(=O)O[C@@H]2CC[C@@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@@H]4CC[C@@]32C)cn1,C12660463_decoy,WEE1,Decoy,0.0,-9.05062,-8.68,-3.04,-9.75096725343723
Cc1cc(C)c(S(=O)(=O)Nc2nnc(CCNC(=O)c3cccc(Br)c3)s2)c(C)c1,C09263064_decoy,WEE1,Decoy,0.0,-7.69688,-8.33,-3.36,-6.21367028237604
O=C(NCc1ccco1)c1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(NC(=O)c2cccs2)c1,C09490775_decoy,WEE1,Decoy,0.0,-8.51452,-9.22,-1.7,-8.62451089905561
CC(=O)N[C@H](Cc1ccccc1F)C(=O)NC1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1,C13565634_decoy,WEE1,Decoy,0.0,-8.13813,-8.96,-3.4,-6.74900447187776
CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)c(Br)c1,C13623344_decoy,WEE1,Decoy,0.0,-8.82938,-8.6,-3.25,-8.233321851267421
CC(C)Oc1ccc(C(=O)NC(=S)Nc2ccc(N3CCN(C(=O)c4ccccc4)CC3)cc2)cc1,C14276621_decoy,WEE1,Decoy,0.0,-8.87533,-8.72,-1.8,-7.162746553168665
O=C(NC(=S)Nc1ccc(N2CCN(C(=O)c3ccccc3)CC2)cc1)c1ccc2c(c1)OCCO2,C14276648_decoy,WEE1,Decoy,0.0,-8.9942,-9.79,-2.77,-7.377701996530708
COCCOc1ccc(C(=O)NC(=S)Nc2sc3c(c2C(=O)OC)CCC3)cc1Br,C14661903_decoy,WEE1,Decoy,0.0,-11.3231,-7.92,-3.21,-14.01454856986578
O=C(C[S@@+]([O-])CC(=O)N(CC(=O)NC1CCCC1)c1cccc2c1CCCC2)Nc1ccc(F)cc1,C20097727_decoy,WEE1,Decoy,0.0,-8.04362,-10.01,-3.17,-8.549119193416157
C=CCOC(=O)C1=C(C)NC(SCC(=O)Nc2c(C)cccc2C)=C(C#N)[C@H]1c1ccccc1OC,C20130547_decoy,WEE1,Decoy,0.0,-8.28627,-7.34,-2.82,-6.953156114197271
COc1ccc(CNC(=O)C(=O)N[C@@H](C)[C@H](c2cccs2)N2CCN(c3ccc(F)cc3)CC2)cc1,C20289034_decoy,WEE1,Decoy,0.0,-10.7219,-8.89,-4.09,-9.204269207107046
O=C(NC[C@@H]1COc2ccccc2O1)c1ccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1,C20683208_decoy,WEE1,Decoy,0.0,-10.1203,-10.23,-1.16,-9.358191120795368
COc1ccc(CCNC(=O)C2CCC(CNS(=O)(=O)c3c(C)cc(C)cc3C)CC2)cc1OC,C20765725_decoy,WEE1,Decoy,0.0,-8.793,-8.68,-4.38,-9.600737191001272
C#CCOc1c(Br)cc(/C=N\NC(=O)[C@H](NC(=O)c2ccc(C)cc2)C(C)C)cc1OC,C30956125_decoy,WEE1,Decoy,0.0,-7.80125,-7.84,-3.68,-8.478212630793823
O=C(CC1CCN(C(=O)c2nnc(C(=O)Nc3ccc(Cl)cc3)s2)CC1)Nc1c(F)cccc1F,C33025069_decoy,WEE1,Decoy,0.0,-8.60003,-9.55,-4.1,-7.6073493752668275
O=C(Cc1csc(NC(=O)CN(C(=O)c2ccccc2)C2CC2)n1)NCc1cccc(C(F)(F)F)c1,C34897619_decoy,WEE1,Decoy,0.0,-8.77063,-9.1,-3.26,-8.332040962818821
CC(C)CCNC(=O)[C@@H]1[C@@H](c2ccc(NC(=O)c3cccs3)cc2)OC(=O)N1Cc1cccc(F)c1,C36220923_decoy,WEE1,Decoy,0.0,-8.69086,-8.59,-1.9,-8.557142086520983
O=C(NC1CCCCC1)[C@H](c1ccco1)N(Cc1ccco1)C(=O)C(O)(c1ccccc1)c1ccccc1,C36502252_decoy,WEE1,Decoy,0.0,-6.4951,-5.08,-1.66,-5.261890815161529
C[C@@]12C=CC(=O)C=C1CC[C@H]1[C@H]2[C@H](O)C[C@]2(C)[C@H]1CC[C@]2(O)C(=O)COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-],C38653529_decoy,WEE1,Decoy,0.0,-8.77446,-5.97,-4.3,-4.452649762705698
Cc1cc(NC(=O)CSc2nnc(CNC(=O)c3ccccc3F)n2C(C)C)ccc1Br,C39741613_decoy,WEE1,Decoy,0.0,-9.53093,-8.72,-2.69,-8.556561879593907
C=CCn1c(CC(=O)Nc2cccc(SC)c2)nnc1S[C@H](C)C(=O)Nc1ccc(F)cc1F,C39768808_decoy,WEE1,Decoy,0.0,-10.2908,-8.79,-3.27,-8.774281510724323
CC(=O)Oc1ccc([C@@H]2[NH2+][C@@](CC3CCCCC3)(C(=O)[O-])[C@@H]3C(=O)N(c4ccccc4C)C(=O)[C@H]32)cc1,C33604700_decoy,WEE1,Decoy,0.0,-8.17855,-4.96,-3.34,-5.74609642953135
COc1ccc([C@@H]2[NH2+][C@@](Cc3ccccc3)(C(=O)[O-])[C@@H]3C(=O)N(c4ccccc4C)C(=O)[C@H]32)c2ccccc12,C33630251_decoy,WEE1,Decoy,0.0,-6.64368,-5.79,-2.21,-4.2068472415447244
Cc1ccc(NC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)[C@@H](C(=O)NCc3ccccc3)C2)cc1,C43259645_decoy,WEE1,Decoy,0.0,-8.23176,-5.14,-2.4,-5.286780166060358
Cc1ccc(NC(=O)N2CCN(C(=O)c3cccc(C(F)(F)F)c3)[C@H](C(=O)NC[C@@H]3CCCO3)C2)cc1,C43260174_decoy,WEE1,Decoy,0.0,-7.68224,-9.79,-3.93,-8.928983609530084
O=C(NC[C@H]1CCCO1)[C@@H]1CN(C(=O)Nc2ccc(F)cc2)CCN1C(=O)c1cccc(C(F)(F)F)c1,C43260507_decoy,WEE1,Decoy,0.0,-8.06241,-7.3,-3.38,-6.416178087865882
COc1ccc(C(=O)N[C@H](C(=O)N[C@@H](C)C(C)C)C2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1,C36210555_decoy,WEE1,Decoy,0.0,-8.13002,-8.72,-3.92,-8.51110418621687
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCc2ccsc2)N2CCN(c3ccc(F)cc3)CC2)cc1,C49504644_decoy,WEE1,Decoy,0.0,-10.5427,-7.48,-3.47,-7.325095838117229
CCCc1nnc(NC(=O)C[C@H](NS(=O)(=O)c2ccc(Br)cc2)c2ccccc2)s1,C54201116_decoy,WEE1,Decoy,0.0,-8.60448,-8.31,-1.24,-8.604530989504108
CCCc1nnc(NC(=O)C[C@@H](NS(=O)(=O)c2ccc(Br)cc2)c2ccccc2)s1,C54201117_decoy,WEE1,Decoy,0.0,-9.89347,-8.34,-2.7,-9.334325144621832
COc1cc(C(=O)NC(=S)NCc2ccc(-c3ccc(Br)cc3)o2)cc(OC)c1OC,C57316321_decoy,WEE1,Decoy,0.0,-8.85034,-6.61,-2.58,-7.874642137229299
C=CCn1c(CNc2ccc(I)cc2)nnc1S[C@H](C)C(=O)N/N=C/C(C)C,C59261419_decoy,WEE1,Decoy,0.0,-10.3902,-8.15,-3.4,-10.522637059442143
COc1ccc([C@@H](CC(=O)CC(=O)/N=C2/N[C@H](c3ccccc3)CS2)NC(=O)c2ccccc2)cc1,C59434839_decoy,WEE1,Decoy,0.0,-8.1839,-7.85,-3.07,-9.035295771663613
COc1ccc([C@H](CC(=O)CC(=O)/N=C2/N[C@@H](c3ccccc3)CS2)NC(=O)c2ccccc2)cc1,C59434842_decoy,WEE1,Decoy,0.0,-7.94519,-9.42,-3.64,-8.695054259263886
C[C@@H]1c2cc3c4c(oc3cc2OC(=O)[C@H]1CC(=O)N[C@@H](CC1=c2ccccc2=[NH+]C1)C(=O)[O-])CCCC4,C63351175_decoy,WEE1,Decoy,0.0,-8.10383,-5.8,-1.96,-5.1399223034897465
CCCN1C(=O)c2c(C(=O)Nc3c(F)c(F)c(F)c(F)c3F)ncn2C[C@@]1(C)C(=O)NC1CCCC1,C64953654_decoy,WEE1,Decoy,0.0,-7.29977,-6.94,-3.97,-6.2768664739012365
Cc1ccc(S(=O)(=O)NN=C2C(C)(C)C(=NNS(=O)(=O)c3ccc(C)cc3)C2(C)C)cc1,C01710084_decoy,WEE1,Decoy,0.0,-7.88407,-7.6,-3.99,-6.575749049438115
Cc1cccc(S(=O)(=O)c2c(N)n(Cc3ccc4c(c3)OCO4)c3nc4ccccc4nc23)c1,C02417773_decoy,WEE1,Decoy,0.0,-7.75442,-8.65,-1.94,-7.101491139052574
Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1c(-c2ccccc2)noc1C,C01033923_decoy,WEE1,Decoy,0.0,-7.51781,-9.7,-1.65,-8.044479509500954
COC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc(C(=O)Nc2cccc(Cl)c2)c1C,C00871457_decoy,WEE1,Decoy,0.0,-9.44983,-9.29,-3.97,-8.476911818845611
O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1,C03832692_decoy,WEE1,Decoy,0.0,-7.36446,-9.67,-3.39,-9.737455483410876
COC(=O)c1ccc([C@@H]2Nn3c(nnc3-c3ccccc3)S[C@H]2C(=O)Nc2ccccc2)cc1,C09236237_decoy,WEE1,Decoy,0.0,-9.01007,-7.51,-0.48,-8.332595468228787
O=C(CN1C(=O)N[C@@](Cc2ccccc2)(c2ccccc2)C1=O)Nc1ccc2c(c1)OC(F)(F)O2,C09585613_decoy,WEE1,Decoy,0.0,-7.49008,-10.11,-2.02,-8.908266714556655
COc1ccccc1NC(=O)C(=O)Nc1ccc2c(c1)N(S(=O)(=O)c1ccc(C)cc1)CCC2,C09739198_decoy,WEE1,Decoy,0.0,-8.91005,-9.94,-2.67,-10.018489823138363
C[C@@]1(c2ccc3c(c2)OCO3)NC(=O)N(CC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)C1=O,C09866533_decoy,WEE1,Decoy,0.0,-8.17417,-6.22,-3.2,-5.152049282026401
CCOC(=O)c1c(NC(=O)CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)sc2c1CC[C@H](C)C2,C09884196_decoy,WEE1,Decoy,0.0,-9.70329,-9.02,-3.93,-8.119165656170788
COc1ccc(-c2nc3cc(C)c(C)cc3o2)cc1NC(=S)NC(=O)c1ccc2c(c1)OCCO2,C09886244_decoy,WEE1,Decoy,0.0,-10.8816,-10.63,-2.4,-10.29566375812286
COc1ccc(N2C[C@@H](C(=O)Nc3c(C(=O)Nc4ccc(F)c(F)c4)oc4ccccc34)CC2=O)cc1,C10246296_decoy,WEE1,Decoy,0.0,-7.855,-10.49,-4.26,-7.834402809662436
Cc1ccc(C2=NN(C(=O)CSc3nnc(-c4ccc(C)cc4)n3N)[C@@H](c3ccco3)C2)cc1,C10784964_decoy,WEE1,Decoy,0.0,-10.8303,-6.11,-4.29,-5.97811602109285
COC(=O)c1ccccc1[C@@H]1NC(=S)N(c2ccc(C)cc2)C(C)=C1C(=O)Nc1cc(C)on1,C11553740_decoy,WEE1,Decoy,0.0,-8.09213,-8.13,-3.21,-7.947995506377705
Cc1cc(=O)[nH]c(-n2nc(-c3ccco3)cc2NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1,C12006320_decoy,WEE1,Decoy,0.0,-7.54593,-9.28,-0.85,-15.128302201412543
Cc1ccccc1NC(=O)c1ccc2c(c1)N(CC(=O)Nc1ccc(N(C)C)cc1)C(=O)C(C)(C)O2,C12645905_decoy,WEE1,Decoy,0.0,-9.4954,-10.81,-2.78,-10.098682093273506
Cc1ccc([C@H](NC(=O)CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCO4)C2=O)c2cccs2)cc1,C12785262_decoy,WEE1,Decoy,0.0,-10.3559,-9.05,-3.13,-9.354009726520948
COc1ccc(S(=O)(=O)N2CCc3nc(NC(=O)Nc4ccc(C)c(F)c4)sc3C2)cc1,C13360642_decoy,WEE1,Decoy,0.0,-9.36702,-8.73,-0.89,-7.615044523457481
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)CC2)cc1,C12548088_decoy,WEE1,Decoy,0.0,-9.25822,-9.57,-3.83,-8.586430616064368
CCc1nc2sc3c(c2c2nnc(SCC(=O)NNC(=O)c4ccc(C)cc4)n12)CC[C@H](C)C3,C13499749_decoy,WEE1,Decoy,0.0,-9.84189,-9.51,-1.57,-9.805997929890122
CCc1nc2sc3c(c2c2nnc(SCC(=O)Nc4ccc(NC(C)=O)cc4)n12)CC[C@H](C)C3,C13499785_decoy,WEE1,Decoy,0.0,-10.0885,-9.12,-3.3,-8.711412353158394
CCc1nc2sc3c(c2c2nnc(SCC(=O)Nc4cccc(NC(C)=O)c4)n12)CC[C@H](C)C3,C13499858_decoy,WEE1,Decoy,0.0,-9.86554,-9.58,-3.75,-9.766523947556037
O=C(NN=Cc1ccc2c(c1)OCO2)/C(=C/c1ccco1)NC(=O)c1ccc(Br)cc1,C13894291_decoy,WEE1,Decoy,0.0,-8.45626,-6.85,-3.03,-6.339358105635957
O=C1CCSc2ccc(S(=O)(=O)Nc3cc(SC4CCCCC4)cc([N+](=O)[O-])c3)cc2N1,C15732081_decoy,WEE1,Decoy,0.0,-9.21942,-5.74,-2.94,-6.044406753422064
O=C(Nc1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1)c1ccc([N+](=O)[O-])cc1,C15891919_decoy,WEE1,Decoy,0.0,-8.83621,-9.11,-3.52,-8.05425788902678
CC1=C(C(=O)Nc2ccc(Br)cn2)[C@@H](c2ccc([N+](=O)[O-])cc2)C2=C(CCCC2=O)N1,C01186183_decoy,WEE1,Decoy,0.0,-9.14456,-4.9,-3.28,-6.385244730941682
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3nc4cc5c(cc4s3)OCCO5)cc2)cc1,C20571416_decoy,WEE1,Decoy,0.0,-9.02352,-10.6,-2.14,-8.404491074619992
Cc1ccc(NS(=O)(=O)c2cccc(C(=O)Nc3nc(-c4ccc5c(c4)OCO5)cs3)c2)cc1,C24785013_decoy,WEE1,Decoy,0.0,-9.79986,-11.39,-1.65,-9.333909064199394
CC(C)(C)c1csc(NC(=O)c2cccc(NS(=O)(=O)c3ccc4c(c3)OCCCO4)c2)n1,C25447193_decoy,WEE1,Decoy,0.0,-9.33849,-9.21,-2.03,-8.228519300053199
CC(=O)N(c1nc(CSc2nnc(-c3ccoc3C)n2N)cs1)c1c(C)cc(C)cc1Cl,C26127808_decoy,WEE1,Decoy,0.0,-9.82421,-7.58,-3.23,-7.4141010980215
CC(C)Oc1ccc([C@@H]2[C@@H]3CN(C(=O)OCc4ccccc4)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1,C26608274_decoy,WEE1,Decoy,0.0,-8.12717,-4.85,-1.37,-4.859866422218096
COc1cc([C@H]2C(C(=O)Nc3ccc(C)cn3)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc(OC)c1OC,C13319895_decoy,WEE1,Decoy,0.0,-8.56944,-5.37,-2.94,-5.543992676007952
Cc1ccc(-n2nc(C)c(NC(=O)CN3C(=O)N[C@@](C)(c4ccc(C(C)(C)C)cc4)C3=O)c2C)cc1,C31637082_decoy,WEE1,Decoy,0.0,-8.66002,-7.15,-3.19,-7.149060864883599
NS(=O)(=O)c1ccc(-c2ccc(/C=c3\sc4nc(/C=C/c5ccccc5)nn4c3=O)o2)cc1,C33779184_decoy,WEE1,Decoy,0.0,-10.0115,-9.06,-1.29,-11.27291752846956
O=C(Cc1cs/c(=N\S(=O)(=O)c2ccc(Cl)cc2)[nH]1)Nc1ccc2oc(=O)ccc2c1,C13689030_decoy,WEE1,Decoy,0.0,-9.47349,-9.5,-1.52,-9.272183023973326
COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccc2)c(OC)c1OC,C02253533_decoy,WEE1,Decoy,0.0,-6.8244,-5.88,-1.05,-4.788581251788244
COc1ccc(C)cc1NC(=O)c1c(C(=O)Nc2cccc(C)c2C)sc2nc(C)cc(=O)n12,C02888154_decoy,WEE1,Decoy,0.0,-8.41631,-5.97,-4.24,-4.744590566671125
COc1ccc(C2=C[C@H]([C@@H]3NN[C@H]4SC(COc5ccc(Br)cc5)=NN43)N=N2)cc1,C38743417_decoy,WEE1,Decoy,0.0,-10.5404,-9.66,-2.39,-9.770664130763969
COc1ccc(C2=C[C@H]([C@@H]3Nn4c(nnc4C(O)(c4ccccc4)c4ccccc4)S3)N=N2)cc1,C38745962_decoy,WEE1,Decoy,0.0,-10.0952,-9.01,-2.88,-8.307551785464574
CCOC(=O)Cn1/c(=N/C(=O)c2ccc(F)cc2Cl)sc2cc(S(N)(=O)=O)ccc21,C38931735_decoy,WEE1,Decoy,0.0,-9.30581,-7.21,-0.83,-7.582656011944373
C[C@H]1[C@@H](NS(=O)(=O)c2ccc3[nH]c(Cc4ccccc4F)nc3c2)C(=O)N(c2ccccc2)N1C,C40049562_decoy,WEE1,Decoy,0.0,-8.54611,-10.27,-2.62,-8.790897075476293
O=C(Nc1nc2c(s1)CCC[C@H]2C(=O)Nc1cccc2ncccc12)c1ccc2c(c1)OCO2,C44441715_decoy,WEE1,Decoy,0.0,-8.92421,-6.79,-4.91,-5.647826660355032
Cc1ccc(NC(=O)NC(=O)CN2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(C)c1,C16517861_decoy,WEE1,Decoy,0.0,-9.81509,-9.71,-3.05,-7.33279536244128
CC(C)Cn1c(SCc2nc(N)c3c4c(sc3n2)C[C@H](C)CC4)nnc1N1CCOCC1,C45599653_decoy,WEE1,Decoy,0.0,-9.34373,-9.24,-0.46,-13.804348941554265
O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc(Br)cc(Br)c1O,C03027411_decoy,WEE1,Decoy,0.0,-8.06371,-8.4,-1.39,-7.76194124490054
C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccc(N3CCN(Cc4ccccc4)CC3)cc1)C2=O,C62733096_decoy,WEE1,Decoy,0.0,-9.73512,-9.45,-2.06,-7.577911281712254
N#CCCc1cccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](c2ccc4c(c2)OCO4)N3)c1,C12847038_decoy,WEE1,Decoy,0.0,-8.56756,-10.67,-1.86,-8.272435365166844
CC1=C(S(=O)(=O)N(CC(=O)N[C@H]2Nc3ccc(C)cc3S2)c2ccc(C)cc2)[C@@H](C)N=N1,C63478901_decoy,WEE1,Decoy,0.0,-8.18166,-9.62,-1.9,-7.806478358551723
CC[C@H]1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCCCCC4)CC3)cc2NC1=O,C64921775_decoy,WEE1,Decoy,0.0,-8.51999,-9.92,-4.28,-7.700019864533872
CC[C@@H]1Oc2ccc(S(=O)(=O)N3CCC(C(=O)NC4CCCCCCC4)CC3)cc2NC1=O,C64921778_decoy,WEE1,Decoy,0.0,-9.33764,-9.96,-3.19,-8.327287742224154
CCOC(=O)N1CCc2c(sc3nc(SCC(=O)c4ccc(Cl)cc4)n(N)c(=O)c23)C1,C02181027_decoy,WEE1,Decoy,0.0,-10.8667,-8.97,-0.98,-15.669007959021616
Cc1c(OCC(=O)NCC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)ccc2c3c(c(=O)oc12)CCCC3,C08918445_decoy,WEE1,Decoy,0.0,-9.07477,-10.1,-1.23,-9.71538701713416
Cc1ccc(S(=O)(=O)N2CCCN(C(=O)CSc3nnc(N)s3)[C@@H]2c2ccccc2)cc1,C09227627_decoy,WEE1,Decoy,0.0,-8.902,-6.07,-3.44,-7.833345105144829
COc1ccc(NC(=O)[C@H]2Sc3nnc(C)n3N[C@@H]2c2ccc(OC)c(Br)c2)cc1,C09237818_decoy,WEE1,Decoy,0.0,-8.68595,-8.08,-1.79,-8.492162601421409
CC(=O)Nc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)Nc3ccc(OC(F)(F)F)cc3)[C@@H]4C2=O)cc1,C09341713_decoy,WEE1,Decoy,0.0,-7.87879,-8.31,-2.53,-6.65330028843134
CC(C)c1csc(NC(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCCO4)cc2)n1,C10556737_decoy,WEE1,Decoy,0.0,-9.71685,-9.36,-2.51,-8.122852982057843
Cc1nc2ccc(NC(=O)c3cccc(NS(=O)(=O)c4ccc5c(c4)OCCO5)c3)cc2s1,C10556879_decoy,WEE1,Decoy,0.0,-9.76157,-10.39,-2.54,-9.392135395435504
C[C@H](NC(=O)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCO3)C1=O)c1ccc(Br)cc1,C11315352_decoy,WEE1,Decoy,0.0,-8.51331,-9.43,-3.87,-9.77348923922564
CC(=O)NCc1ccc(-c2csc(NC(=O)C3CCN(c4nc5ccccc5o4)CC3)n2)s1,C11744320_decoy,WEE1,Decoy,0.0,-9.70986,-7.87,-2.93,-6.954424721830264
Cc1c(S(=O)(=O)NC2CCC(n3cc(C(=O)NC4CC4)nn3)CC2)sc2ccc(Cl)cc12,C11815649_decoy,WEE1,Decoy,0.0,-10.0962,-9.32,-3.14,-7.989952603645633
Cn1cc(S(=O)(=O)N2CCN(C(=O)c3ccc(SC(F)(F)F)cc3)CC2)cc1C(N)=O,C12929084_decoy,WEE1,Decoy,0.0,-7.60205,-6.61,-2.67,-5.34108311300226
CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccc4c(=O)n5c(nc4c3)CCCCCC5)n2)s1,C14066156_decoy,WEE1,Decoy,0.0,-8.34585,-7.84,-1.43,-6.826903998443534
CCc1ccc(-n2nc3cc(C)c(NC(=S)NC(=O)c4ccc5c(c4)OCCO5)cc3n2)cc1,C14270938_decoy,WEE1,Decoy,0.0,-9.92657,-7.06,-2.7,-6.329120260783602
CC(=O)N(c1nc(/C=C/C(=O)NNC(=O)c2cn(C)c3ccccc23)cs1)c1ccccc1F,C15093087_decoy,WEE1,Decoy,0.0,-8.55506,-8.71,-3.14,-7.255479027144538
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CNC(=O)c1ccc(Br)o1,C15738731_decoy,WEE1,Decoy,0.0,-9.07301,-8.17,-3.12,-8.881681513266537
O=C(Nc1ccccc1F)[C@@H]1[C@H]2C(=O)N(c3cccnc3)[C@H](C(=O)NC3CCCCC3)[C@]23C=C[C@H]1O3,C04093087_decoy,WEE1,Decoy,0.0,-8.15266,-6.28,-2.01,-6.593440161562496
Cc1cc(C)c(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(-c4ccc(=O)[nH]n4)s3)C2)c(C)c1,C20762449_decoy,WEE1,Decoy,0.0,-9.99615,-8.15,-2.4,-8.915649589008003
CC(C)[C@@H](NC(=O)CN1C(=O)N[C@](C)(c2ccc(F)c(F)c2)C1=O)c1ccc2c(c1)OCCCO2,C21734403_decoy,WEE1,Decoy,0.0,-9.67218,-9.68,-2.74,-10.922546724228129
C[C@H](NC(=O)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCCCO3)C1=O)C12CC3CC(CC(C3)C1)C2,C22429094_decoy,WEE1,Decoy,0.0,-7.80891,-9.79,-4.3,-9.16499480586838
O=C(COC(=O)c1ccc(C2SCCCS2)cc1)NC(=O)Nc1ccc2c(c1)OCCO2,C23065123_decoy,WEE1,Decoy,0.0,-9.66637,-9.33,-2.18,-7.846958204357513
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(S(=O)(=O)N4C[C@H](C)C[C@H](C)C4)cc3)sc2c1,C17244900_decoy,WEE1,Decoy,0.0,-9.22579,-9.44,-3.17,-7.363740121637743
C[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1,C24286608_decoy,WEE1,Decoy,0.0,-8.77316,-9.28,-2.8,-7.039119006454852
Cc1ccc([C@@H]2C(C#N)=C(SCC(=O)Nc3ccc4c(c3)OCO4)NC3=C2C(=O)CC(C)(C)C3)o1,C03336210_decoy,WEE1,Decoy,0.0,-10.3773,-10.23,-1.99,-14.507616574260853
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)Nc3ccc(NC(=O)c4ccco4)cc3)C2)s1,C30816146_decoy,WEE1,Decoy,0.0,-9.19431,-9.12,-3.06,-7.226472004432923
O=C(Nc1ccccc1)Nc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccccc3F)CC2)cc1,C30958514_decoy,WEE1,Decoy,0.0,-8.28074,-9.51,-1.67,-7.446734800016863
CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nn2-c2ccccc2)c1,C31675196_decoy,WEE1,Decoy,0.0,-7.36178,-9.59,-1.69,-7.486255125798285
NC(=O)[C@H]1CN(C(=O)c2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2)c2ccccc2O1,C32986196_decoy,WEE1,Decoy,0.0,-8.45564,-9.29,-2.18,-7.690432083144731
CC(=O)Nc1c(-c2ccc(C)cc2)c(C)nn1-c1ccc(C(=O)Nc2ccc3c(c2)OCCO3)cc1,C33037212_decoy,WEE1,Decoy,0.0,-8.13749,-6.61,-1.9,-5.446672159337378
Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3nnc(C(=O)Nc4cccc(Cl)c4)s3)C2)c1,C33263360_decoy,WEE1,Decoy,0.0,-9.54248,-9.74,-3.63,-7.958129471513649
C[C@@H]1Oc2ccc(S(=O)(=O)N3CCC[C@H](C(=O)Nc4ccc(Cl)cc4F)C3)cc2NC1=O,C35220034_decoy,WEE1,Decoy,0.0,-7.70392,-6.19,-2.21,-4.395916131211943
C[C@H](C(=O)NC(=O)NC1CCCCC1)N1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1,C12698024_decoy,WEE1,Decoy,0.0,-8.90222,-9.14,-3.29,-7.459379565684032
Cc1cc(F)ccc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2cc3c(cc2C)NC(=O)[C@H](C)O3)C1,C35379185_decoy,WEE1,Decoy,0.0,-9.66305,-10.06,-3.11,-8.620376708138785
COc1cc(C2=NN=C3OC(N)=C(C#N)[C@H](c4ccc(Br)cc4)[C@H]32)cc(OC)c1OC,C06239275_decoy,WEE1,Decoy,0.0,-9.42895,-8.66,-1.74,-8.849347035752528
CC1(C)[C@]2(C)CC[C@@]1(C(=O)NNC(=O)c1ccc(Br)cc1)c1nc(C#N)c(C#N)nc12,C39846398_decoy,WEE1,Decoy,0.0,-8.38212,-5.05,-3.24,-4.394019179972173
Cc1c([C@@H](C)NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cnn1-c1cccc(C(F)(F)F)c1,C40062332_decoy,WEE1,Decoy,0.0,-8.13943,-8.92,-2.06,-11.537352339540732
O=C(Nc1cccc(S(=O)(=O)/N=C2/CCCCCN2)c1)c1cc(C2CC2)nn1-c1ccccc1,C15719201_decoy,WEE1,Decoy,0.0,-9.14637,-10.41,-3.48,-10.133413061620368
O=C(NN1C(=O)/C(=C/c2ccc(O)c([N+](=O)[O-])c2)SC1=S)c1ccc(Br)cc1,C40940475_decoy,WEE1,Decoy,0.0,-8.99867,-6.53,-2.05,-5.887268426424145
O=C(NCC1CCN(C(=O)Nc2cccs2)CC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1,C44004504_decoy,WEE1,Decoy,0.0,-9.22193,-10.19,-2.93,-11.204653455586628
CCOC(=O)c1c(NC(=O)CN2C[C@H](C(=O)NC)Oc3ccccc32)sc2c1CC[C@@H](C)C2,C45471253_decoy,WEE1,Decoy,0.0,-8.95402,-8.57,-3.29,-10.454358004366387
O=C(Nc1ccccc1)Nc1ccc(C(=O)N2CCN(C(=O)c3ccccc3OC(F)F)CC2)cc1,C46718438_decoy,WEE1,Decoy,0.0,-8.22175,-8.42,-2.99,-7.1351191667635
Cc1occc1C(=O)Nc1cc(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)ccc1F,C46840244_decoy,WEE1,Decoy,0.0,-8.68539,-10.2,-2.35,-9.845588186607015
O=C(NC[C@@H]1COC2(CCCCC2)O1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccs1,C49504293_decoy,WEE1,Decoy,0.0,-9.34041,-8.67,-2.34,-7.649406636975097
O=C(C[C@@H]1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)Nc2nc3c(s2)CCCC3)c1,C09909492_decoy,WEE1,Decoy,0.0,-10.419,-10.38,-1.58,-10.503240800293591
Cc1ccc(C2=C[C@H](c3ccco3)N(C(=O)CN3C(=O)N[C@]4(CCCc5ccccc54)C3=O)N2)cc1,C03336212_decoy,WEE1,Decoy,0.0,-8.69354,-7.53,-2.46,-6.285462752227377
Cc1nn(Cc2ccccc2)c(C)c1NC(=O)c1cnn2c1N[C@H](c1ccco1)C[C@H]2C(F)(F)F,C13623749_decoy,WEE1,Decoy,0.0,-7.24957,-8.75,-2.11,-8.15144459343464
C=CCn1/c(=N/C(=O)c2cccc(S(=O)(=O)C(C)C)c2)sc2cc(S(N)(=O)=O)ccc21,C12309225_decoy,WEE1,Decoy,0.0,-10.5872,-7.35,-2.62,-7.567892335112481
Cc1cc(C)cc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3cc4c(cc3C)NC(=O)[C@H](C)O4)C2)c1,C35379142_decoy,WEE1,Decoy,0.0,-9.55304,-10.23,-3.09,-10.17008094651568
Cc1ccc(C)c(S(=O)(=O)[N-]c2c[nH+]c(N3CCC([NH+]4CCCCC4)CC3)c(C(=O)[O-])c2)c1,C35397540_decoy,WEE1,Decoy,0.0,-8.26819,-10.43,-2.8,-9.686887011922355
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc(F)c(F)c2)c[nH+]c1N1CCC([NH+]2CCCCC2)CC1,C35397563_decoy,WEE1,Decoy,0.0,-8.50262,-8.65,-2.08,-6.909139925351326
CC[C@@H]1Oc2ccc(S(=O)(=O)N3CCC(C(=O)Nc4ccc(Cl)cc4)CC3)cc2NC1=O,C64921750_decoy,WEE1,Decoy,0.0,-8.48752,-10.01,-3.24,-8.31641885868442
O=C([O-])/C(=C\c1cccc(NC(=O)C(F)(F)F)c1)Sc1nnc(-c2ccc3c(c2)OCO3)o1,C11332716_decoy,WEE1,Decoy,0.0,-9.07767,-9.2,-2.0,-11.092187161986374
C[C@H](Nc1ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)cc1[N+](=O)[O-])c1ccc2c(c1)CCCC2,C13181514_decoy,WEE1,Decoy,0.0,-8.75487,-11.17,-3.85,-9.65747010973486
CN(CC(=O)Nc1ccccc1C(=O)[O-])C(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1,C13184333_decoy,WEE1,Decoy,0.0,-7.59416,-7.88,-1.75,-6.857771123227485
CN(CC(=O)Nc1ccccc1C(=O)[O-])C(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1,C13185302_decoy,WEE1,Decoy,0.0,-7.7089,-10.05,-2.07,-8.604738869542249
O=C([O-])c1cc(S(=O)(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)ccc1O,C13197819_decoy,WEE1,Decoy,0.0,-7.45478,-8.7,-1.37,-6.389633519639008
O=C([O-])C1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2NCc2ccc3c(c2)OCCO3)CC1,C13211458_decoy,WEE1,Decoy,0.0,-8.14027,-8.85,-1.53,-11.726510388949022
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NS(=O)(=O)c1ccc(F)c(C(=O)[O-])c1,C13247345_decoy,WEE1,Decoy,0.0,-8.88375,-8.8,-1.96,-8.646948453928859
COc1cc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)c(Cl)cc1C(=O)[O-],C13261136_decoy,WEE1,Decoy,0.0,-9.05996,-8.43,-1.66,-8.554328537925004
O=C([O-])c1cc(S(=O)(=O)Nc2ccccc2C(=O)Nc2ccc3c(c2)OCCO3)ccc1F,C13262027_decoy,WEE1,Decoy,0.0,-7.5286,-10.0,-1.19,-8.400012709630015
CCc1sc(C(=O)N/N=C(\C)c2ccc(S(=O)(=O)N3CCCC[C@H]3C(=O)[O-])cc2)cc1C,C13264453_decoy,WEE1,Decoy,0.0,-9.39484,-7.75,-2.69,-6.911209037891938
CS(=O)(=O)N1CCN(c2ccc(S(=O)(=O)Nc3ccccc3C(=O)[O-])cc2[N+](=O)[O-])CC1,C13274921_decoy,WEE1,Decoy,0.0,-4.75688,-8.89,-3.87,-5.977508487055501
Cc1cc(C)nc(SCC(=O)NNS(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)n1,C13346430_decoy,WEE1,Decoy,0.0,-9.10107,-8.73,-2.44,-10.596745727805096
O=C(CSc1ccc2c(c1)OCCO2)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)[O-])C2)cc1,C13398062_decoy,WEE1,Decoy,0.0,-10.122,-9.41,-1.39,-8.030027400291212
O=C([O-])/C=C/c1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1,C13402183_decoy,WEE1,Decoy,0.0,-8.69599,-9.66,-2.45,-7.42545354130539
C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)Nc3cc4c(cc3C(=O)[O-])OCCO4)cc2)C[C@H](C)O1,C13430036_decoy,WEE1,Decoy,0.0,-9.09949,-10.17,-2.4,-8.260124023242325
COc1cc(C(=O)[O-])c(NC(=O)C2CCN(C(=O)c3cccc4ccccc34)CC2)c(OC)c1OC,C13445372_decoy,WEE1,Decoy,0.0,-8.59716,-5.64,-2.36,-4.699489885349614
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@]1(CC(=O)[O-])CC(c2ccc(Br)cc2)=NO1,C15973415_decoy,WEE1,Decoy,0.0,-7.72265,-9.18,-2.69,-8.472339955231275
NC(=O)[C@H]1CCN2c3ccc([N+](=O)[O-])cc3C[C@]3(C(=O)N(c4ccc(Cl)cc4)C(=O)N=C3[O-])[C@@H]2C1,C14943771_decoy,WEE1,Decoy,0.0,-7.24823,-5.63,-3.05,-5.0701797256693
Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)n(-c2nc([O-])c3cnn(-c4ccc(F)cc4)c3n2)n1,C21113002_decoy,WEE1,Decoy,0.0,-9.01513,-9.82,-0.98,-10.41330321212791
CC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)Nc3ccc4c(c3)CCN4C(C)=O)cc2)cc1,C22643402_decoy,WEE1,Decoy,0.0,-8.81932,-10.93,-1.06,-18.12700909152671
O=C(CSc1nc2cc([N+](=O)[O-])ccc2s1)Nc1cc([O-])nc(=O)n1-c1ccc(Cl)cc1,C01921408_decoy,WEE1,Decoy,0.0,-8.68624,-8.01,-1.79,-9.241504493318866
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)Cn3c([S-])nnc3-c3cccs3)n2)cc1,C29120016_decoy,WEE1,Decoy,0.0,-10.4556,-7.21,-0.67,-7.406252849877251
Cc1ccc(NC2C([N+](=O)[O-])=CC(=C([O-])n3c(C)cc(=O)n(C(C)C)c3=S)C=C2[N+](=O)[O-])c(C)c1,C33781679_decoy,WEE1,Decoy,0.0,-6.43915,-7.82,-3.21,-6.054846570552979
CC(=O)N[C@@H]1[C@@H](Oc2cccc3ccccc23)O[C@@H]2CO[C@H](c3ccccc3)O[C@@H]2[C@@H]1OCC(=O)[O-],C35057842_decoy,WEE1,Decoy,0.0,-4.56566,-6.02,-2.42,-3.687351440346147
CC(=O)N[C@H]1[C@@H](Oc2ccc3ccccc3c2)O[C@@H]2CO[C@H](c3ccccc3)O[C@@H]2[C@H]1OCC(=O)[O-],C35057845_decoy,WEE1,Decoy,0.0,-6.2009,-5.15,-1.93,-5.585557451402765
CC(=O)N[C@H]1[C@@H](Oc2ccc(Cl)cc2Cl)O[C@@H]2CO[C@H](c3ccco3)O[C@@H]2[C@@H]1OCC(=O)[O-],C35058013_decoy,WEE1,Decoy,0.0,-5.30981,-4.63,-4.44,-2.928392505735617
O=C(Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1)c1cccc(-c2nnn[n-]2)c1,C35354800_decoy,WEE1,Decoy,0.0,-8.86566,-10.95,-1.61,-7.892920400576688
CC(C)c1nn(-c2ccc([N+](=O)[O-])cc2)c([O-])c1/C=C1\NC(=O)N(Cc2ccc(C#N)cc2)C1=O,C35455604_decoy,WEE1,Decoy,0.0,-7.95581,-8.3,-0.94,-6.718624722799249
C=C1C[C@H]2[C@](C)(CCC(=O)[O-])[C@@H](C(C)(C)O)CC[C@]2(C)[C@H]2C(=O)O[C@@](C)(C(=O)OC)C(=O)[C@]12C,C35465703_decoy,WEE1,Decoy,0.0,-8.19662,-5.89,-4.76,-3.942389860267534
O=C(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1,C13518951_decoy,WEE1,Decoy,0.0,-8.93802,-8.7,-2.66,-7.842732758360665
Cc1cc(C)cc(C(=O)N[C@@H]2C(=O)N3C(C(=O)[O-])=C(CSc4nnc(C)s4)CS[C@@H]23)c1,C02803210_decoy,WEE1,Decoy,0.0,-10.5604,-7.5,-1.99,-9.168786555979004
CCn1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2nc([O-])c3c(n2)CCCC3)c(=O)c2ccc(C)nc21,C38741288_decoy,WEE1,Decoy,0.0,-9.45914,-10.23,-3.79,-9.282129266234776
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)/N=c2/[nH]c(-c3ccc4c(c3)CCO4)cs2)c1OC,C13460367_decoy,WEE1,Decoy,0.0,-9.36576,-8.1,-5.48,-7.769064356310052
C=CCN1C(=O)[C@@H]2C3=C(C[C@H](C)CC3)S[C@@H]2N[C@@H]1SCc1nc2oc(C)c(C(=O)[O-])c2c(=O)[nH]1,C39680063_decoy,WEE1,Decoy,0.0,-8.62812,-7.94,-2.49,-8.80597827571036
CCOC(=O)[C@@H]1C2=C(CCCCC2)S[C@H]1NC(=O)[C@@H](C)Sc1nnc2nc([O-])c3c(n12)CCC3,C39733495_decoy,WEE1,Decoy,0.0,-9.67067,-8.59,-1.55,-7.818282581322959
CCOC(=O)[C@H]1C2=C(CCCC2)S[C@H]1NC(=O)[C@@H](C)Sc1nnc2nc([O-])c3c(n12)CCCC3,C39733506_decoy,WEE1,Decoy,0.0,-8.63737,-8.04,-3.9,-7.300841084950419
C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)Nc1ccc(S(=O)(=O)[N-]c3nccs3)cc1)C2=O,C12520843_decoy,WEE1,Decoy,0.0,-8.35157,-9.81,-2.91,-7.6319375528312445
CCOC(=O)C1=C(N)OC2=NC(=S)N=C([O-])[C@@H]2[C@]12C(=O)N1c3c(cc(C)cc32)[C@@H](C)CC1(C)C,C39939031_decoy,WEE1,Decoy,0.0,-6.33058,-5.25,-1.93,-2.9403189754014973
Cc1ccc([C@H]2C(C(=O)c3ccc(S(=O)(=O)N4CCCCCC4)cc3)=C([O-])C(=O)N2CCO)o1,C40112198_decoy,WEE1,Decoy,0.0,-8.72662,-6.33,-3.54,-6.460640291580604
O=C(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)c1ccc(S(=O)(=O)c2ccccc2)o1,C40321251_decoy,WEE1,Decoy,0.0,-9.09234,-9.93,-1.42,-8.468536794690612
CCOC(=O)c1c[nH]nc1S(=O)(=O)[N-]c1cccc(C(=O)N2CCc3sccc3C2)c1C,C45527476_decoy,WEE1,Decoy,0.0,-8.92105,-7.43,-1.34,-7.9167126262149425
COc1cc([C@@H]2c3sc([O-])nc3S[C@@H]3C(=O)N(c4ccc([N+](=O)[O-])cc4)C(=O)[C@H]23)ccc1O,C47145955_decoy,WEE1,Decoy,0.0,-7.30368,-5.6,-3.33,-5.0944004983433455
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)[C@H]3CCCN(C(=O)Nc4cccs4)C3)cc2)n1,C49429160_decoy,WEE1,Decoy,0.0,-8.56225,-7.95,-2.49,-7.055755308721307
Cc1ccc(S(=O)(=O)N[C@]2(C(F)(F)F)C(=O)N=C3C2=C([O-])NC(=O)N3Cc2ccco2)cc1,C01884936_decoy,WEE1,Decoy,0.0,-6.66991,-6.96,-2.67,-6.847019623858421
COc1cc(/C=C2/C(=O)N(c3cc(C)c(C)cc3Br)C(=O)N=C2[O-])cc(OC)c1O,C59862277_decoy,WEE1,Decoy,0.0,-8.49624,-8.19,-3.36,-7.713687574303133
Cc1ccc(S(=O)(=O)N[C@@]2(C(F)(F)F)C(=O)Nc3c2c(=O)nc([O-])n3-c2ccccc2)cc1,C01874671_decoy,WEE1,Decoy,0.0,-6.36383,-5.89,-5.1,-4.347640010452733
Cc1ccc(-n2c([O-])nc(=O)c3c2NC(=O)[C@]3(NS(=O)(=O)c2ccc(C)cc2)C(F)(F)F)cc1,C01880744_decoy,WEE1,Decoy,0.0,-6.92235,-6.03,-3.05,-4.410571450022925
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)NC(=O)[C@H](C(=O)N2CCCC2)S3)cc1,C65021431_decoy,WEE1,Decoy,0.0,-7.70576,-9.05,-2.69,-7.2271853899394385
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C(=O)N2CCCC2)S3)cc1,C65021432_decoy,WEE1,Decoy,0.0,-9.47235,-9.37,-5.47,-7.88218133146689
O=C(Cn1c2c(sc1=O)[C@@H](c1ccc(O)cc1)[C@H]1C([O-])=NC(=O)[C@H]1S2)Nc1ccc(F)cc1,C39884128_decoy,WEE1,Decoy,0.0,-6.77835,-9.7,-2.99,-7.856387395325413
COc1ccc(C(=O)N2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)Nc4cc(OC)cc(OC)c4)c(=O)n2C3)cc1,C04236425_decoy,WEE1,Decoy,0.0,-7.4013,-7.92,-2.17,-5.826938559098393
CN(C)c1cccc(Oc2nnnn2[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3NC(=O)Nc2cccc(C(F)(F)F)c2)c1,C04147673_decoy,WEE1,Decoy,0.0,-7.31056,-9.4,-3.86,-7.571076342772257
COc1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1S(=O)(=O)N1CCOCC1,C03364813_decoy,WEE1,Decoy,0.0,-9.58627,-8.86,-2.44,-11.65966061048949
O=C(Nc1ccc(=O)n2c1[C@@H]1C[C@@H](CN(C(=O)Nc3ccc(F)cc3)C1)C2)c1ccc2c(c1)OCO2,C08300371_decoy,WEE1,Decoy,0.0,-7.32842,-7.75,-3.32,-5.620106358742747
COC(=O)NC(=O)c1c(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)sc2c1CC[C@H](C)C2,C08897905_decoy,WEE1,Decoy,0.0,-9.70347,-8.54,-4.56,-9.200947295105149
Cc1cccc(N2C[C@@H](C(=O)Nc3nnc(SCC(=O)Nc4ccc5c(c4)OCO5)s3)CC2=O)c1,C08905665_decoy,WEE1,Decoy,0.0,-9.20737,-8.27,-2.19,-6.854625977306251
COc1cc(/C=N/n2c(-c3cc(OC)c(OC)c(OC)c3)n[nH]c2=S)cc(Br)c1O,C09012989_decoy,WEE1,Decoy,0.0,-9.84386,-7.96,-0.9,-8.739170793818506
CCOC(=O)c1c(NC(=O)[C@H](C)Sc2nnc3[nH]c(=O)c4c(n23)CCC4)sc2c1CCCC2,C09018874_decoy,WEE1,Decoy,0.0,-8.69251,-8.73,-2.99,-8.6429115371255
CCOC(=O)Cn1/c(=N/C(=O)c2cc(Cl)ccc2[N+](=O)[O-])sc2cc(S(N)(=O)=O)ccc21,C09078299_decoy,WEE1,Decoy,0.0,-8.93124,-7.62,-3.91,-7.575226763222939
CCOc1cccc2cc(C(=O)/N=c3\sc4cc(S(N)(=O)=O)ccc4n3CC(=O)OC)oc12,C08962757_decoy,WEE1,Decoy,0.0,-9.53119,-6.12,-1.17,-5.406518556002621
COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccc5c(c4)OCO5)c(=O)c32)cc(OC)c1OC,C02245934_decoy,WEE1,Decoy,0.0,-9.16437,-9.29,-0.82,-8.983786709564782
O=C(Nc1sc2c(c1C(=O)N[C@H]1CCS(=O)(=O)C1)CCCC2)c1ccc(Cl)c([N+](=O)[O-])c1,C09428054_decoy,WEE1,Decoy,0.0,-9.49971,-10.31,-0.85,-10.949852017162822
COC(=O)N1CCc2c(sc(NC(=O)c3cccc(NS(=O)(=O)c4ccccc4)c3)c2C#N)C1,C09325703_decoy,WEE1,Decoy,0.0,-10.6503,-9.98,-0.83,-8.928939179302608
CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cncn2-c2ccc(F)cc2)c1,C09884220_decoy,WEE1,Decoy,0.0,-8.8553,-5.1,-2.37,-5.268591735622854
COC(=O)NC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)sc2c1CC[C@@H](C)C2,C10098861_decoy,WEE1,Decoy,0.0,-11.0312,-9.27,-1.89,-9.267260846795986
Cc1cccc(N2C[C@@H](C(=O)Nc3c(C(=O)Nc4ccc5c(c4)OCO5)oc4ccccc34)CC2=O)c1,C10246864_decoy,WEE1,Decoy,0.0,-8.03792,-10.94,-3.7,-8.78446287663891
C=CCN1C(=S)N[C@H](c2ccc(Br)c([N+](=O)[O-])c2)C(C(=O)Nc2cc(C)on2)=C1C,C10354491_decoy,WEE1,Decoy,0.0,-7.28049,-6.35,-1.62,-4.67033851762764
C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Br)C2=O,C10753199_decoy,WEE1,Decoy,0.0,-8.37488,-8.76,-4.01,-11.07666714552641
CCOC(=O)NC(=O)c1c(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)sc2c1CCCC2,C10785850_decoy,WEE1,Decoy,0.0,-10.1597,-5.56,-1.16,-6.787743287343816
CC(C)(C)c1ccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc3c(c2)OCCO3)cc1,C10891557_decoy,WEE1,Decoy,0.0,-9.54287,-9.6,-3.01,-7.6087440130180894
O=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1cccc(S(=O)(=O)N[C@H]2CCS(=O)(=O)C2)c1,C11328334_decoy,WEE1,Decoy,0.0,-8.07761,-9.42,-2.08,-7.024285119044406
O=C(Nc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1)c1ccc(Cl)cc1[N+](=O)[O-],C11325235_decoy,WEE1,Decoy,0.0,-7.93445,-9.52,-1.83,-7.720708754801722
COc1ccc(/C=c2\sc3n(c2=O)C(N)=C(C#N)[C@@H](c2ccc(OC)cc2OC)C=3C#N)c(OC)c1,C12419939_decoy,WEE1,Decoy,0.0,-7.72778,-7.58,-1.84,-6.626841088102946
COC(=O)NC(=O)c1c(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)sc2c1CCCCC2,C12465563_decoy,WEE1,Decoy,0.0,-10.7284,-7.41,-2.97,-9.17819729888456
CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1cc(S(=O)(=O)N3CCCCC3)ccc1C)C2=O,C13073836_decoy,WEE1,Decoy,0.0,-8.3564,-9.98,-3.27,-8.673165212770774
CCOC(=O)c1c(NC(=O)CN2C(=O)N[C@@](C)(c3ccc4c(c3)OCCO4)C2=O)sc2c1CCC2,C14358358_decoy,WEE1,Decoy,0.0,-8.87795,-8.97,-1.72,-7.522010138393077
Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)C1,C16201616_decoy,WEE1,Decoy,0.0,-8.71897,-8.99,-1.03,-8.410052344615911
Cc1ccc(NC(=O)NC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)cc1C,C16252507_decoy,WEE1,Decoy,0.0,-9.87901,-9.94,-3.19,-12.292012775955248
COc1ccc([C@H](NC(=O)/C=C\c2ccc3c(c2)OCO3)C(=O)Nc2ccc3c(c2)OCCO3)cc1,C20108285_decoy,WEE1,Decoy,0.0,-7.41059,-9.66,-3.23,-6.793401943591593
CCOC(=O)c1c(NC(=O)CN2C(=O)N[C@@](C)(c3ccc(C#N)cc3)C2=O)sc2c1CC[C@H](C)C2,C20795794_decoy,WEE1,Decoy,0.0,-9.73025,-9.08,-3.21,-9.51274524624062
CC(=O)Nc1ccc(NC(=O)c2cnn(-c3ccc(F)cc3)c2C2CCN(C(=O)OC(C)(C)C)CC2)cc1,C21089612_decoy,WEE1,Decoy,0.0,-8.08834,-5.17,-2.16,-5.704497910678391
Cn1cc(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(C4CCCCC4)cc3)CC2)cc1C(N)=O,C22023832_decoy,WEE1,Decoy,0.0,-10.0341,-7.38,-1.16,-7.187397713810904
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1,C28791841_decoy,WEE1,Decoy,0.0,-8.11183,-9.0,-2.49,-7.150308559515748
Cc1ccc(NC(=O)C2CCN(C(=O)c3nnc(C(=O)Nc4ccc5c(c4)OCO5)s3)CC2)cc1C,C33024668_decoy,WEE1,Decoy,0.0,-9.08516,-9.64,-2.11,-8.476804723013647
Cc1cc(C)c(S(=O)(=O)Nc2ccc(N3CC[NH+](CC(=O)N(C)C)CC3)cc2C(=O)[O-])c(C)c1,C33260009_decoy,WEE1,Decoy,0.0,-7.81994,-9.18,-3.74,-7.236069023627789
COc1ccc(NC(=O)c2nnc(C3CCN(C(=O)Nc4cc(OC)ccc4OC)CC3)s2)cc1,C33273023_decoy,WEE1,Decoy,0.0,-8.81958,-8.47,-3.94,-8.24011035600243
CC(=O)N[C@@H]1[C@@H](Oc2ccc(C(=O)/C=C/c3ccccc3)cc2)O[C@@H]2CO[C@H](c3ccco3)O[C@@H]2[C@H]1O,C35056780_decoy,WEE1,Decoy,0.0,-7.50791,-8.93,-4.43,-6.884245562399183
COc1ccc(NC(=O)N2CCC[C@H]2C(=O)Nc2nnc(-c3ccc4c(c3)OCO4)s2)c(OC)c1,C35729475_decoy,WEE1,Decoy,0.0,-9.30638,-9.57,-2.13,-8.253499251845001
Cc1ccc(-n2c(SCc3nc(C(=O)N[C@H]4CCCCNC4=O)cs3)nnc2-c2cccnc2)cc1,C35752352_decoy,WEE1,Decoy,0.0,-8.8929,-9.38,-1.72,-7.987937473961496
CC[C@H](C)NC(=O)[C@@H](NC(=O)c1ccc2c(c1)OCO2)C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1,C36211566_decoy,WEE1,Decoy,0.0,-8.91253,-10.41,-4.14,-8.288928734059178
CC(=O)c1cccc(N2C(=O)[C@@H]3[C@H](C(=O)Nc4cc(C)on4)[C@]4(C)C=C[C@]3(O4)[C@H]2C(=O)NC(C)(C)C)c1,C33939919_decoy,WEE1,Decoy,0.0,-8.22956,-5.5,-2.35,-5.4454113395382455
CCOC(=O)Cn1/c(=N/C(=O)Cn2c(=O)oc3ccccc32)sc2cc(S(N)(=O)=O)ccc21,C38931754_decoy,WEE1,Decoy,0.0,-7.03888,-8.09,-3.55,-6.731424770635863
Cc1ccc(S(=O)(=O)NNc2ncnc(N3CCN(c4ccc(F)cc4)CC3)c2[N+](=O)[O-])cc1,C40659310_decoy,WEE1,Decoy,0.0,-7.84289,-8.03,-1.91,-6.556386296396525
COc1ccccc1[C@H]1[NH2+][C@@](C(=O)[O-])(c2ccccc2)[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12,C43218761_decoy,WEE1,Decoy,0.0,-7.78433,-5.15,-4.25,-4.502353502171572
COc1ccccc1[C@@H]1[NH2+][C@](CC2CCCCC2)(C(=O)[O-])[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]21,C33899976_decoy,WEE1,Decoy,0.0,-7.9464,-9.34,-2.6,-9.355976142385495
Cc1nc(C)c(C(=O)N/N=C\c2ccc3c(c2)OCO3)cc1C(=O)N/N=C\c1ccc2c(c1)OCO2,C33513710_decoy,WEE1,Decoy,0.0,-8.80932,-10.05,-2.37,-9.861223650357555
CS(=O)(=O)N1CCCc2ccc(NC(=O)C(=O)NC[C@@H](c3ccco3)N3CCc4ccccc4C3)cc21,C49490837_decoy,WEE1,Decoy,0.0,-9.54804,-8.11,-2.14,-8.141430817118172
CC1=C(C(=O)N2CCN(S(=O)(=O)c3sc(=O)[nH]c3C)CC2)[C@H](Cl)N(c2ccc(F)cc2)N1,C39790134_decoy,WEE1,Decoy,0.0,-7.95906,-8.56,-3.72,-6.5596924444386655
CCOC(=O)N1CCC(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](c2ccc4c(c2)OCO4)N3)CC1,C03012217_decoy,WEE1,Decoy,0.0,-9.0086,-9.03,-2.76,-7.89788838485131
COc1ccc(OC)c(NC(=O)Nc2nc3c(s2)CN(S(=O)(=O)c2ccc(C)cc2)CC3)c1,C65083487_decoy,WEE1,Decoy,0.0,-8.4693,-7.75,-1.47,-7.257889805930955
CC(C)(C)c1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccc(Cl)cc2)cc1,C04163750_decoy,WEE1,Decoy,0.0,-8.77359,-5.23,-2.68,-5.777561080405491
C=C(NNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccc2c(c1)Nc1ccccc1S2,C03226725_decoy,WEE1,Decoy,0.0,-8.76818,-10.8,-2.36,-8.617271270168128
C[C@H](NC(=O)c1cc(NC(=O)Nc2ccc(Cl)cc2Cl)ccc1N(C)C)c1ccccc1,C04212612_decoy,WEE1,Decoy,0.0,-7.88895,-9.9,-3.03,-8.289091044458416
CC(C)c1ccc(C(=O)NC(=S)Nc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)cc1,C02995015_decoy,WEE1,Decoy,0.0,-9.94755,-10.6,-1.92,-9.378017802288902
COc1c(C)cccc1C(=O)NC(=S)Nc1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1,C08833062_decoy,WEE1,Decoy,0.0,-8.83516,-9.17,-4.5,-7.315325066390991
Cc1ccccc1/C=N/n1c(N)c(C(=O)N[C@@H](C)CCc2ccccc2)c2nc3ccccc3nc21,C02207905_decoy,WEE1,Decoy,0.0,-8.63066,-6.99,-1.75,-6.005503982798064
CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)/C=C/c3cccc4ccccc34)cc2)cc1,C12492055_decoy,WEE1,Decoy,0.0,-9.22438,-10.17,-3.31,-6.914975137513849
CCOC(=O)c1ccc(NC(=O)c2sc3nc4c(c(C(F)(F)F)c3c2N)C[C@H](CC)CC4)cc1,C12858083_decoy,WEE1,Decoy,0.0,-8.84399,-8.91,-1.17,-7.760653953777039
COC(=O)c1ccc([C@@H]2Nc3ccc(/C(C)=N/NC(=O)c4ccccc4O)cc3[C@@H]3C=CC[C@@H]32)cc1,C09010261_decoy,WEE1,Decoy,0.0,-10.0544,-6.95,-2.03,-5.748702834656784
CCc1ccc(NC(=O)Nc2cc(C)c3nc(NS(=O)(=O)c4ccc(C)cc4)sc3c2)cc1,C13349160_decoy,WEE1,Decoy,0.0,-9.22512,-9.47,-3.74,-8.022282358396113
COc1c(Cl)cc(C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C(C)(C)C)C3)cc1Cl,C14273325_decoy,WEE1,Decoy,0.0,-10.3591,-8.27,-0.25,-17.365720453560016
Cc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@H](c2c[nH]c4ccccc24)N3)c(C)c1,C14544791_decoy,WEE1,Decoy,0.0,-8.84714,-9.91,-2.2,-8.022315738023341
Cc1ccc2[nH]c(SCC(=O)Nc3cccc(NC(=O)C45CC6CC(CC(C6)C4)C5)c3)nc2c1,C15932036_decoy,WEE1,Decoy,0.0,-9.16482,-9.64,-3.52,-7.129907069319745
C[C@H](NC(=O)c1cc(NC(=O)Nc2cccc3ccccc23)ccc1N(C)C)c1ccccc1,C16568093_decoy,WEE1,Decoy,0.0,-8.59253,-10.04,-2.07,-12.962015600549863
CC[C@H](C)[C@@H](NC(=O)Nc1cccc(C)c1)C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C16572263_decoy,WEE1,Decoy,0.0,-8.62633,-7.65,-2.56,-9.41733836231194
CC[C@@H](C)[C@@H](NC(=O)Nc1ccc(C)cc1)C(=O)Nc1nnc(-c2cccc(Br)c2)s1,C16572736_decoy,WEE1,Decoy,0.0,-9.3117,-8.4,-1.94,-8.164695912297848
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@@H]1c1cccc(NC(=O)Nc2ccc(C)cc2C)c1,C16612386_decoy,WEE1,Decoy,0.0,-8.92543,-9.06,-1.95,-10.29536377175491
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(NC(=O)Nc3cccc(F)c3)cc2)N2CCCSC2=N1,C16613956_decoy,WEE1,Decoy,0.0,-8.35472,-8.72,-1.84,-9.953274143688532
CC[C@@H](C)c1ccc(NC(=O)CCSc2nnc(-c3ccc(Br)cc3)n2N)cc1,C20830460_decoy,WEE1,Decoy,0.0,-9.26671,-8.07,-2.05,-8.52850631544849
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2SCc2cccs2)c1,C25613576_decoy,WEE1,Decoy,0.0,-8.97291,-8.52,-2.48,-8.326245720669364
Cc1ccc([C@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)NCc4cc5cc(Cl)ccc5[nH]4)cc3N2)cc1,C01009152_decoy,WEE1,Decoy,0.0,-8.7363,-10.01,-1.93,-8.56616082543856
Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3cc(Cl)c(Cl)cc3Cl)n2N)cc1,C28387870_decoy,WEE1,Decoy,0.0,-9.43528,-8.81,-3.88,-10.664833729831676
Cc1cc(NC(=S)NC(=O)c2cccs2)cc(-c2nc3cc(C(C)C)ccc3o2)c1O,C30826268_decoy,WEE1,Decoy,0.0,-9.76274,-9.16,-1.6,-10.166054833539691
Cc1ccc(C(=O)NC(=S)Nc2cc(C)c(O)c(-c3nc4cc(C(C)C)ccc4o3)c2)cc1,C30826862_decoy,WEE1,Decoy,0.0,-10.3958,-9.56,-1.74,-10.674253514625176
CC[C@@H](C(=O)Nc1scc(-c2ccc(C)cc2)c1C(N)=O)n1c(=O)cc(C)c2cc(C)cc(C)c21,C32527474_decoy,WEE1,Decoy,0.0,-7.88143,-9.39,-4.35,-7.583604144109007
Cc1cc(C)cc(N/C(=N/CCc2c[nH]c3ccccc23)NC(=O)c2ccc(Br)cc2)c1,C32943129_decoy,WEE1,Decoy,0.0,-9.00988,-5.52,-2.37,-5.599524220553891
Cc1cccc(C(=O)Nc2ccc(N3CCCC3)c(NC(=O)Nc3ccc(Br)cc3)c2)c1,C33009227_decoy,WEE1,Decoy,0.0,-8.68752,-6.38,-3.46,-5.272072728438967
O=C(Nc1cccc(Br)c1)Nc1cc(NC(=O)c2ccc(F)cc2)ccc1N1CCCC1,C33009807_decoy,WEE1,Decoy,0.0,-9.05309,-9.62,-4.35,-8.877425996065053
O=C(Nc1ccc(N2CCCC2)c(C(=O)NCc2ccc(F)cc2)c1)NC12CC3CC(CC(C3)C1)C2,C33658260_decoy,WEE1,Decoy,0.0,-8.14949,-8.69,-2.42,-13.569489055975284
CC[C@@H](C)[C@@H](NC(=O)Nc1ccc(C)cc1)C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C33735578_decoy,WEE1,Decoy,0.0,-8.9108,-6.29,-1.75,-5.858726562598928
Cc1ccc(CN(Cc2ccc(S(N)(=O)=O)cc2)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1,C34933283_decoy,WEE1,Decoy,0.0,-9.26779,-7.58,-4.6,-7.912934682318898
Cc1ccc(NC(=O)N(CCNC(=O)Nc2c(C)cccc2C)c2cccc(C(F)(F)F)c2)cc1,C34946527_decoy,WEE1,Decoy,0.0,-6.10128,-9.33,-3.44,-7.10827799806605
CC[C@@H](C)[C@H](NC(=O)NC1CCCCC1)C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C35268121_decoy,WEE1,Decoy,0.0,-9.6609,-7.96,-0.8,-8.385777809534803
C[C@H](Sc1nnc(-c2ccc(Cl)cc2Cl)n1N)C(=O)NC12CC3CC(CC(C3)C1)C2,C23449540_decoy,WEE1,Decoy,0.0,-9.76877,-7.18,-0.9,-9.185042266801524
CC[C@@H](C)[C@@H](NC(=O)Nc1cccc(C)c1C)C(=O)Nc1nnc(-c2ccc(C)cc2)s1,C35724966_decoy,WEE1,Decoy,0.0,-8.9212,-7.93,-3.42,-7.726463417100246
CC[C@H](C)[C@@H](NC(=O)Nc1ccccc1Br)C(=O)Nc1nnc(-c2ccc(F)cc2)s1,C35729064_decoy,WEE1,Decoy,0.0,-8.86718,-8.74,-1.16,-7.963651538146856
Cc1ccc([C@H](C(=O)NC(C)(C)CC(C)(C)C)N(C(=O)c2c(O)cccc2O)C(C)(C)C)c(C)c1,C36586620_decoy,WEE1,Decoy,0.0,-5.67305,-5.4,-4.02,-3.66023765533916
Cc1ccccc1[C@@H](C(=O)NC(C)(C)CC(C)(C)C)N(C(=O)c1cccc(O)c1O)C(C)(C)C,C36586935_decoy,WEE1,Decoy,0.0,-5.26526,-4.7,-4.28,-3.35562517656954
CC1(C)[C@H]2CC[C@@H](CNC(=O)c3ccc(-n4nc(-c5cccc(C(F)(F)F)c5)cc4N)cc3)[C@@H]1C2,C38737054_decoy,WEE1,Decoy,0.0,-8.94846,-10.17,-1.6,-18.427420545841645
Oc1cccc(-c2conc3sc(N4N[C@@H](C(F)(F)F)C[C@@H]4c4ccc5ccccc5c4)cn3[nH]2)c1,C39940316_decoy,WEE1,Decoy,0.0,-10.7396,-9.3,-1.97,-8.079302685143551
Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Nc1ncnc(N2CCCC[C@H]2C)c1N,C40688658_decoy,WEE1,Decoy,0.0,-7.5927,-10.14,-1.41,-6.132042339018383
Nc1c(Nc2ccc(Br)cc2F)ncnc1N(Cc1ccccc1)Cc1ccccc1,C40709637_decoy,WEE1,Decoy,0.0,-7.40357,-8.73,-3.44,-2.412034348160664
CC(C)Oc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(OCc5ccccc5)cc4)c32)cc1,C09292711_decoy,WEE1,Decoy,0.0,-7.75141,-6.21,-1.82,-5.30041760614723
N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1cccc(OCc2cccc3ccccc23)c1,C00622887_decoy,WEE1,Decoy,0.0,-9.51123,-10.04,-2.01,-8.829510638201132
N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)cc3)c2[C@@H]1c1ccc(OCc2cccc(Cl)c2)cc1,C20437310_decoy,WEE1,Decoy,0.0,-8.45703,-6.26,-1.25,-5.2994874073903375
Cc1ccccc1NC(=O)c1cc2ccccc2c(/C=N/Nc2nc3ccccc3s2)c1O,C16134262_decoy,WEE1,Decoy,0.0,-10.0052,-11.48,-1.39,-11.806530815057156
O=C(Nc1ccc(Br)cc1)Nc1ccccc1C(=O)Nc1ccc(Br)cc1,C20246662_decoy,WEE1,Decoy,0.0,-8.84349,-9.68,-2.33,-8.557213219732859
C=CCc1cccc(/C=N/NC(=O)[C@@H](C)Nc2ccc(I)c(C)c2)c1O,C20352483_decoy,WEE1,Decoy,0.0,-7.61199,-7.44,-1.82,-6.772158173670959
C/C(=N\Nc1nc(SCC(=O)Nc2ccc(C)cc2C)n[nH]1)C12CC3CC(CC(C3)C1)C2,C59310652_decoy,WEE1,Decoy,0.0,-10.2627,-9.9,-2.99,-10.353903592882352
C/C(=N\Nc1nc(SCC(=O)Nc2cc(C)ccc2C)n[nH]1)C12CC3CC(CC(C3)C1)C2,C59310754_decoy,WEE1,Decoy,0.0,-10.5462,-9.95,-2.91,-11.830580836842811
[NH3+]CC(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2-c2ccc3c(ccc4ccccc43)c2)cc1,C03960083_decoy,WEE1,Decoy,0.0,-8.89132,-5.06,-3.04,-4.905402303740254
Fc1ccc(CNc2nc(C[NH2+]Cc3ccc(F)cc3)nc3sc4c(c23)CCCC4)cc1,C02661624_decoy,WEE1,Decoy,0.0,-10.1055,-10.29,-4.2,-11.244611799342824
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C[NH2+]Cc3ccco3)c2C(=O)Nc2ccc(Cl)cc2)C1,C08918719_decoy,WEE1,Decoy,0.0,-9.26939,-8.5,-1.78,-8.537590344006809
C[C@H]1CCc2c(sc(NC(=O)C[NH2+]CCc3ccccc3)c2C(=O)Nc2ccccc2F)C1,C08919164_decoy,WEE1,Decoy,0.0,-10.2518,-8.91,-2.44,-10.072190599894688
COc1ccc([C@@H]2N=C(c3ccc(C)cc3)C[C@H](c3ccccc3O)[NH2+]2)cc1Br,C09542835_decoy,WEE1,Decoy,0.0,-9.72384,-9.75,-3.12,-8.060798711650833
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH2+][C@H](C)Cc4ccsc4)CC3)cc2)c(C)c1,C11881114_decoy,WEE1,Decoy,0.0,-9.57984,-8.8,-1.96,-7.649816822728435
O=C(NC1CCCC1)c1ccc(N2CCC([NH2+]Cc3cccc(C(F)(F)F)c3)CC2)cc1,C12246835_decoy,WEE1,Decoy,0.0,-10.3634,-9.29,-3.92,-8.837652165531553
Cc1sc2nc(C[NH2+]Cc3ccc(Cl)cc3)nc(NCc3ccc(Cl)cc3)c2c1C,C02661613_decoy,WEE1,Decoy,0.0,-8.75047,-6.26,-2.28,-6.288256340631817
CCC[C@@H]1[C@H](c2ccc(OC)cc2)[NH2+][C@@H](c2ccc(OC)cc2)C[C@@]1(O)C#Cc1ccccc1,C13750556_decoy,WEE1,Decoy,0.0,-8.31078,-4.39,-3.11,-4.655380905057564
[NH3+][C@@H](CC(=O)N1CCc2nc(-c3ccc(C(F)(F)F)cc3)sc2C1)Cc1cc(F)ccc1F,C14949000_decoy,WEE1,Decoy,0.0,-8.97246,-8.95,-4.51,-11.800728596325898
Cc1cc(F)ccc1NC(=O)CC[C@H]1CCC[NH+](Cc2ccc(C#CC(C)(C)O)s2)C1,C14980411_decoy,WEE1,Decoy,0.0,-9.29979,-8.5,-2.88,-8.46874258667543
Cc1cccc(NC(=O)c2c(NC(=O)C[NH+]3CCC(C)CC3)sc3c2CC[C@H](C(C)(C)C)C3)c1,C15946720_decoy,WEE1,Decoy,0.0,-11.6205,-5.64,-3.57,-6.724875188518575
COc1ccc(CN(C(=S)Nc2ccc(C)c(C)c2)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C19630560_decoy,WEE1,Decoy,0.0,-8.32001,-7.01,-1.75,-7.236790133760442
Cc1cc[nH+]c(NC(NC(=O)c2ccc(Cl)cc2Cl)(C(F)(F)F)C(F)(F)F)c1,C20426679_decoy,WEE1,Decoy,0.0,-7.39705,-5.29,-2.95,-6.134713609174098
COc1cc(Cl)ccc1NC(=S)N(Cc1cccs1)C1CC(C)(C)[NH2+]C(C)(C)C1,C20568238_decoy,WEE1,Decoy,0.0,-8.40382,-5.5,-2.77,-4.6131512937832415
COc1ccc(C2=N[C@H](c3ccc(F)cc3)[NH2+][C@@H](c3cc(Br)ccc3O)C2)cc1,C20763135_decoy,WEE1,Decoy,0.0,-8.67716,-6.74,-1.16,-6.228244785605093
COc1ccc(C2=N[C@H](c3ccc(C(F)(F)F)cc3)[NH2+][C@@H](c3cc(Cl)ccc3O)C2)cc1,C20764563_decoy,WEE1,Decoy,0.0,-8.30581,-4.93,-1.9,-4.838672885139176
COc1ccc([C@H]2N=C(c3ccc(C)cc3)C[C@@H](c3ccccc3O)[NH2+]2)cc1Br,C20764833_decoy,WEE1,Decoy,0.0,-9.02281,-6.57,-3.25,-5.062430073249729
COc1ccc(CN(C(=S)NC2CCCCCCC2)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C21262168_decoy,WEE1,Decoy,0.0,-8.45112,-6.73,-4.64,-6.781334699815608
CC1(C)CC(NC(=S)N(Cc2ccc(C(C)(C)C)cc2)Cc2cccnc2)CC(C)(C)[NH2+]1,C21263166_decoy,WEE1,Decoy,0.0,-8.71195,-8.6,-0.96,-8.767864952962121
C[C@H](c1ccccc1)N(Cc1ccc(N(C)C)cc1)C(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1,C21263410_decoy,WEE1,Decoy,0.0,-9.01115,-7.85,-4.0,-9.514311154452816
COc1ccc(Cl)cc1NC(=S)N(Cc1ccccc1C)C1CC(C)(C)[NH2+]C(C)(C)C1,C22567569_decoy,WEE1,Decoy,0.0,-8.12044,-7.57,-2.48,-7.660590688944453
c1ccc2c(c1)nnn2[C@H](NC1CCCCC1)[C@@H]([NH2+]C1CCCCC1)n1nnc2ccccc21,C23469481_decoy,WEE1,Decoy,0.0,-6.85207,-6.53,-1.58,-4.596376764212854
CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2ccc(NC(=O)Nc3ccccc3)cc2)N2CCCSC2=[NH+]1,C35350232_decoy,WEE1,Decoy,0.0,-10.3037,-5.73,-4.19,-6.250396549952713
Cc1cccc(N[C@H](c2ccccc2F)c2c(NC(=O)c3ccccc3)sc(C)c2C)[nH+]1,C35476887_decoy,WEE1,Decoy,0.0,-11.1621,-5.52,-3.41,-6.340768950990294
OCCNc1nc(OCC(F)(F)F)nc(N2CC[NH+](C34CC5CC(CC(C5)C3)C4)CC2)n1,C04079164_decoy,WEE1,Decoy,0.0,-8.31833,-7.45,-2.61,-7.61967963148562
OC[C@@H]([NH2+]Cc1ccc(/N=C/c2cc(Br)ccc2O)cc1)C12CC3CC(CC(C3)C1)C2,C38172971_decoy,WEE1,Decoy,0.0,-10.1172,-7.02,-2.89,-6.675096794906552
Cc1cc[nH+]c(N[C@H](c2ccc(F)cc2)c2c(NC(=O)c3ccccc3)sc(C)c2C)c1,C38547039_decoy,WEE1,Decoy,0.0,-11.748,-5.15,-3.14,-7.029133506351386
CC1(C)CC2=C([C@H]([NH+]=C(Nc3ccccc3)Nc3ccccc3)C1)[C@]1(O)CC(C)(C)C[C@](C)(C2)C1,C08385057_decoy,WEE1,Decoy,0.0,-9.71554,-4.89,-2.35,-5.53792016086589
Cc1ccc(C)c(S(=O)(=O)/N=C2\[NH+]=c3ccccc3=[NH+][C@@H]2Nc2ccc(C(=O)[O-])cc2)c1,C38984178_decoy,WEE1,Decoy,0.0,-8.45567,-8.87,-2.17,-8.078571528047124
CC1(C)CC(N(Cc2ccccn2)C(=S)Nc2ccc(Cl)cc2C(F)(F)F)CC(C)(C)[NH2+]1,C39422056_decoy,WEE1,Decoy,0.0,-9.47693,-8.7,-3.47,-8.988932611242134
CC1(C)CC(N(Cc2cccnc2)C(=S)Nc2cc(Cl)ccc2C(F)(F)F)CC(C)(C)[NH2+]1,C39432378_decoy,WEE1,Decoy,0.0,-8.29965,-8.35,-4.0,-9.463417721235473
S=C(NCc1ccccc1)N/[NH+]=c1/oc2ccccc2cc1-c1ccc(Br)cc1,C39916658_decoy,WEE1,Decoy,0.0,-8.0456,-6.66,-2.48,-5.304313961427575
CC[C@H](C)[C@H]([NH3+])c1nc(C(=O)NC[C@@]2(C)CCC[C@]3(C)c4ccc(C(C)C)cc4CC[C@@H]23)co1,C43213497_decoy,WEE1,Decoy,0.0,-9.17054,-7.22,-4.53,-7.492994399010125
Cc1ccc(CNC(=O)[C@@H]2CSC[C@H](c3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)[NH2+]2)cc1,C44168482_decoy,WEE1,Decoy,0.0,-9.96156,-8.16,-3.8,-8.382390135762341
CCc1cc2c(cc1[C@H]1C[S@@+]([O-])C[C@@H](C(=O)NCCc3ccccc3F)[NH2+]1)C(C)(C)CCC2(C)C,C44170591_decoy,WEE1,Decoy,0.0,-10.5661,-7.43,-2.18,-8.165999741303574
CCc1cc2c(cc1[C@@H]1C[S@@+]([O-])C[C@@H](C(=O)NCc3cc(F)ccc3F)[NH2+]1)C(C)(C)CCC2(C)C,C44171456_decoy,WEE1,Decoy,0.0,-9.02617,-9.29,-1.95,-7.752438025131272
CCc1ccc(NC(=S)N(Cc2ccccc2OC)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C59088250_decoy,WEE1,Decoy,0.0,-9.63718,-8.67,-3.76,-8.947703776400902
COc1ccccc1CN(C(=S)Nc1cccc(Cl)c1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59088454_decoy,WEE1,Decoy,0.0,-8.51325,-6.41,-2.32,-5.218372619745044
CCc1cccc(CC)c1NC(=S)N(Cc1ccc(C)o1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59092672_decoy,WEE1,Decoy,0.0,-7.75388,-8.21,-2.3,-8.076488838774187
O=S(=O)(N[C@@H](c1ccccc1)[C@H]([NH2+]C1CCCCC1)c1ccccc1)c1ccc(Cl)cc1,C59121210_decoy,WEE1,Decoy,0.0,-9.41064,-7.77,-4.0,-5.424704842296591
COc1ccc(CN(C(=S)Nc2cccc(C)c2C)C2CC(C)(C)[NH2+]C(C)(C)C2)cc1,C59169865_decoy,WEE1,Decoy,0.0,-8.31966,-8.69,-3.01,-8.19568990537984
COC(=O)c1ccccc1NC(=S)N(Cc1ccccc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59187207_decoy,WEE1,Decoy,0.0,-8.68738,-8.89,-1.73,-8.716530394903375
CCc1ccccc1NC(=S)N(Cc1ccccc1OC)C1CC(C)(C)[NH2+]C(C)(C)C1,C59199596_decoy,WEE1,Decoy,0.0,-8.67846,-9.53,-3.13,-9.26696617576019
CCOc1cc(C[NH2+]C23C[C@@H]4C[C@@H](CC(O)(C4)C2)C3)cc(Br)c1OCc1ccc(C)cc1,C13729225_decoy,WEE1,Decoy,0.0,-10.0164,-8.66,-1.37,-14.136187174335934
[O-]c1c(Br)cc(Cl)cc1/C=[NH+]/CC/[NH+]=C/c1cc(Cl)cc(Br)c1O,C09262189_decoy,WEE1,Decoy,0.0,-9.25251,-7.18,-3.1,-7.948442475537285
O=C(Nc1cccc([C@H]2NC[C@@H](c3ccccc3Cl)C3=c4ccccc4=[NH+][C@@H]32)c1)c1ccc(Cl)cc1,C63236996_decoy,WEE1,Decoy,0.0,-9.22321,-9.8,-4.59,-7.872958626765512
O=C(Nc1cccc([C@@H]2NC[C@@H](c3ccccc3Cl)C3=c4ccccc4=[NH+][C@@H]32)c1)c1ccc(Cl)cc1,C63237000_decoy,WEE1,Decoy,0.0,-7.62532,-8.86,-4.33,-5.999889435018716
C[C@@H]1[NH+]=c2ccccc2=C1CCNC(=O)/C(=C/c1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1,C63513888_decoy,WEE1,Decoy,0.0,-9.05675,-9.04,-3.52,-9.595360414062409
Cc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@H]2Nc2ccc(C(=O)O)cc2)c(C)c1,C38971664_decoy,WEE1,Decoy,0.0,-8.43454,-10.39,-1.39,-8.549949493952507
C[C@@H](NC(=O)c1cc(NC(=O)Nc2ccc(C(F)(F)F)cc2)ccc1N(C)C)c1ccccc1,C04211923_decoy,WEE1,Decoy,0.0,-7.50692,-7.05,-3.33,-5.603106855596345
Cc1c(C)c(C)c(CNNC(=S)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(C)c1C,C01735890_decoy,WEE1,Decoy,0.0,-10.2391,-8.96,-3.77,-7.951909687086085
CC(C)c1cc(Br)ccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N,C02841702_decoy,WEE1,Decoy,0.0,-10.6799,-9.17,-4.38,-14.115902391261832
Cc1cc(N/N=C/c2ccccc2O)nc(-c2cc(Br)cc(Br)c2O)n1,C08444961_decoy,WEE1,Decoy,0.0,-8.52202,-6.01,-2.09,-5.066458466369809
Nc1c(C(=O)Nc2ccccc2)c2nc3ccccc3nc2n1/N=C/c1cccc(Br)c1,C02265761_decoy,WEE1,Decoy,0.0,-9.43979,-6.74,-2.41,-8.531135041961813
Cc1cccc(NC(=O)CSc2ncc(S(=O)(=O)c3ccc(C(C)C)cc3)c(N)n2)c1C,C09152121_decoy,WEE1,Decoy,0.0,-10.3932,-8.97,-2.43,-8.670292269724268
Cc1ccc(-c2nnc(SCC(=O)Nc3c(Br)cc(C)cc3Br)n2N)cc1,C02377007_decoy,WEE1,Decoy,0.0,-9.22421,-7.29,-1.89,-7.286712435676106
CCN(Cc1ccccc1)c1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccccc2)cc1,C11859250_decoy,WEE1,Decoy,0.0,-9.61705,-7.69,-2.83,-8.66897286764073
C[C@H](NC(=O)c1c(N)n(-c2ccc(Br)cc2)c2nc3ccccc3nc12)c1ccccc1,C02291747_decoy,WEE1,Decoy,0.0,-8.78165,-6.44,-1.88,-6.344474774860922
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=S)NC(=O)c1ccc(Cl)cc1Cl,C12501461_decoy,WEE1,Decoy,0.0,-10.3062,-8.23,-3.46,-9.840138301850732
CC1=C(C(=O)Nc2ccc(Br)cc2)[C@H](c2ccc(-c3ccc(F)cc3)o2)NC(=O)N1,C12564597_decoy,WEE1,Decoy,0.0,-8.68597,-9.13,-2.72,-8.901150390125348
O=C(Nc1cccc(Cl)c1)Nc1cccc(S(=O)(=O)Nc2ccc(SC(F)F)cc2)c1,C12572944_decoy,WEE1,Decoy,0.0,-9.37421,-6.37,-2.66,-6.72035696158667
Cc1ccc(C(C)C)c(OCC(=O)NNC(=S)NC(=O)c2ccc(C)c(Br)c2)c1,C12573248_decoy,WEE1,Decoy,0.0,-8.3063,-8.07,-2.39,-7.44971671159682
COc1c(C)cc(Br)cc1C(=O)NC(=S)Nc1ccc(NC(=O)c2ccco2)c(C)c1,C01124226_decoy,WEE1,Decoy,0.0,-8.32927,-8.71,-2.7,-6.959487795087389
Cc1ccc(S(=O)(=O)Nc2nc3c(C)cc(NC(=O)Nc4cccc(Cl)c4)cc3s2)cc1,C13349148_decoy,WEE1,Decoy,0.0,-10.4045,-5.78,-1.47,-5.615762976152739
Cc1cc(O)c(C)c(O)c1/C=N/NC(=O)COc1ccc(Cl)cc1I,C00910219_decoy,WEE1,Decoy,0.0,-9.78977,-8.57,-3.17,-8.144879289928422
Cc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2)cc1,C13978366_decoy,WEE1,Decoy,0.0,-8.04778,-9.57,-3.42,-8.794050998994729
O=C(/C=C/c1cccc2ccccc12)NC(=S)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1,C13981838_decoy,WEE1,Decoy,0.0,-9.14989,-9.03,-2.27,-7.203472597177363
CC(C)(C)C(=O)NC(=S)NNC(=O)COc1ccc2cc(Br)ccc2c1Br,C13988374_decoy,WEE1,Decoy,0.0,-8.63521,-8.44,-1.68,-8.015481622853077
Cc1ccc(C(=O)NC(=S)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1Br,C14031773_decoy,WEE1,Decoy,0.0,-9.04264,-9.4,-2.48,-8.483639772373962
CC(C)COc1ccccc1C(=O)NC(=S)NNC(=O)c1ccccc1I,C14035296_decoy,WEE1,Decoy,0.0,-8.11262,-6.83,-3.62,-6.620718535840774
COc1cc2ccccc2cc1C(=O)NC(=S)Nc1ccc(NC(=O)Cc2ccccc2)cc1,C14271244_decoy,WEE1,Decoy,0.0,-10.6205,-10.57,-1.44,-8.913830505694625
O=C(NC(=S)Nc1ccc(NC(=O)c2cc3ccccc3o2)cc1)c1cccc(Br)c1,C14276161_decoy,WEE1,Decoy,0.0,-10.5508,-9.65,-3.19,-12.141834888741464
C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1,C14644379_decoy,WEE1,Decoy,0.0,-9.54172,-8.75,-1.83,-10.920674192006274
O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1,C17397468_decoy,WEE1,Decoy,0.0,-8.64591,-9.94,-3.63,-7.551076658775812
Cc1cc(Br)ccc1NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Cl)cc1,C17958711_decoy,WEE1,Decoy,0.0,-9.19181,-8.8,-3.26,-8.2307597404339
Cc1cc(C)cc(OCc2nnc(S[C@H](C)C(=O)Nc3ccc(C)cc3Br)n2N)c1,C18744549_decoy,WEE1,Decoy,0.0,-8.59541,-9.18,-1.89,-8.15064975725793
O=C(NCc1nc2ccccc2n1C(=O)Nc1cccc2ccccc12)Nc1cccc2ccccc12,C19015508_decoy,WEE1,Decoy,0.0,-7.84014,-11.23,-1.81,-9.65959961355956
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccccc2F)C(C#N)=C(SCC(=O)Nc2ccccc2)N1,C12250850_decoy,WEE1,Decoy,0.0,-9.93418,-6.36,-3.25,-5.995872251322536
CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2cccc(Cl)c2)N1,C09057655_decoy,WEE1,Decoy,0.0,-9.09095,-5.33,-3.12,-6.393805650081843
O=C(CSc1n[nH]c(N/N=C/c2cccc3ccccc23)n1)Nc1ccc(C(F)(F)F)cc1,C20905309_decoy,WEE1,Decoy,0.0,-8.79533,-7.44,-2.3,-6.3090927855113375
C/C(=N\Nc1nnc(SCC(=O)C2C3CC4CC(C3)CC2C4)n1N)c1ccc2ccccc2c1,C21323641_decoy,WEE1,Decoy,0.0,-9.80758,-10.05,-1.55,-10.213734609191746
O=C(/C=C/c1ccc(-c2ccccc2)o1)NC(=S)Nc1ccc(NC(=O)c2cccs2)cc1,C21595761_decoy,WEE1,Decoy,0.0,-10.2067,-6.64,-2.48,-7.434414336082567
Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1,C25531512_decoy,WEE1,Decoy,0.0,-9.17019,-9.15,-2.73,-7.749644116160369
Cc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)OCC(=O)Nc2ccc(C(N)=O)cc2)cc1,C28365029_decoy,WEE1,Decoy,0.0,-9.60103,-6.88,-3.24,-6.775805593404754
Cc1cc(/C=C2/NC(=S)NC2=O)c(C)n1-c1sc2c(c1C(=O)Nc1ccccc1)CCCC2,C32189088_decoy,WEE1,Decoy,0.0,-8.63751,-6.08,-3.78,-4.6765892414245815
O=C(NCCC1=CCCCC1)c1ccc([C@@H]2Nc3cc(C(F)(F)F)ccc3S(=O)(=O)N2)cc1,C33063356_decoy,WEE1,Decoy,0.0,-9.4426,-6.86,-0.94,-5.534956115446367
Cc1ccc(NC(=O)c2[nH]cnc2/N=C2/SC[C@@](O)(c3ccc(C)cc3)N2c2ccccc2)cc1,C16949341_decoy,WEE1,Decoy,0.0,-8.28544,-6.2,-4.66,-4.580871572763126
O=C(NCCN(C(=O)Nc1cccc(C(F)(F)F)c1)c1ccc(F)cc1)NCc1ccccc1,C34976349_decoy,WEE1,Decoy,0.0,-6.20293,-9.21,-1.84,-7.3693412456289344
CC1CCN(c2ccc(NC(=O)Nc3ccccc3Br)cc2C(=O)NC(C)C)CC1,C35227842_decoy,WEE1,Decoy,0.0,-9.89382,-7.94,-2.8,-8.48546347904741
CCc1ccccc1NC(=O)N[C@@H](C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1)[C@H](C)CC,C35724680_decoy,WEE1,Decoy,0.0,-8.54988,-8.72,-1.86,-6.811342356838264
Cc1ccc(NC(=O)N2CCC([C@H](NC(=O)c3ccc(F)cc3)C(=O)Nc3ccccc3)CC2)cc1,C36148154_decoy,WEE1,Decoy,0.0,-8.55594,-6.34,-3.79,-5.557561468731807
C[C@@]1(c2ccccc2O)CN(c2ccccc2O)C(=O)N1CC1(C2CCCCC2)CCN(O)CC1,C39488172_decoy,WEE1,Decoy,0.0,-9.11547,-6.11,-0.9,-6.146087588000563
Cc1ccccc1NC(=O)[C@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)Nc2ccccc2C)[C@@H]1c1ccc(OC(C)C)cc1,C41006611_decoy,WEE1,Decoy,0.0,-9.12847,-5.89,-2.94,-5.99037895353726
CC(C)Oc1ccc([C@H]2[C@@H](C(=O)Nc3ccccc3)C(=O)C[C@@](C)(O)[C@@H]2C(=O)Nc2ccccc2)cc1,C41006882_decoy,WEE1,Decoy,0.0,-8.09466,-5.59,-3.09,-5.559388929154837
Cc1ccc([C@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)Nc4ccc([C@@H](C)O)cc4)c(Cl)c3N2)cc1,C08711966_decoy,WEE1,Decoy,0.0,-7.84159,-5.91,-3.78,-4.4072331274972925
CCC(=O)Nc1nc2ccc(NC(=S)NC(=O)c3cc(Br)cc(C)c3OC)cc2s1,C57313078_decoy,WEE1,Decoy,0.0,-11.3904,-8.82,-2.7,-9.663905289627564
Cc1ccc(/C=c2\sc3n(c2=O)C(N)=C(C#N)[C@H](c2ccc(C)cc2)C=3C(=O)NCc2ccccc2)cc1,C59293490_decoy,WEE1,Decoy,0.0,-9.39185,-8.32,-1.3,-8.198260106584847
CC1=C(C(=O)N/N=C/c2ccc(N(C)C)cc2)[C@@H](c2ccc(Br)cc2)NC(=S)N1,C59384849_decoy,WEE1,Decoy,0.0,-10.186,-8.51,-2.55,-13.303179962243952
Cc1ccc(-c2csc(-n3[nH]c(-c4ccccc4)c([C@@H](c4ccccc4)[C@H](C#N)C(N)=O)c3=O)n2)cc1,C59461865_decoy,WEE1,Decoy,0.0,-8.80054,-6.28,-1.54,-5.865808055511824
NC(=O)c1c(NC(=O)c2ccc(Br)s2)sc2c1CCCC2,C04070211_decoy,WEE1,Decoy,0.0,-9.27356,-8.27,-3.57,-8.551178529881758
C[C@@H]1CCc2sc(NC(=O)c3ccc(Cl)s3)c(C(N)=O)c2C1,C01518498_decoy,WEE1,Decoy,0.0,-10.4771,-8.15,-0.07,-9.074989492536684
NC(=O)c1c(NC(=O)c2ccc3ccccc3c2)sc2c1CCCCC2,C04176873_decoy,WEE1,Decoy,0.0,-8.99386,-9.65,-1.99,-8.086497204870835
Cc1cc(C)c([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)c(C)c1C(Cl)Cl,C00828666_decoy,WEE1,Decoy,0.0,-6.08898,-5.53,-0.59,-2.7841815342338254
C[C@@H]1CCc2c(sc(NC(=O)c3ccc(Cl)cc3Cl)c2C(N)=O)C1,C00687072_decoy,WEE1,Decoy,0.0,-9.56566,-9.11,0.51,-8.615708230193066
NNc1nc(-c2ccccc2)nc2c1C1(CCCC1)Cc1ccccc1-2,C00492588_decoy,WEE1,Decoy,0.0,-8.55376,-10.32,-1.1,-11.500109330542616
Cc1ccc(-n2c(C)cc(/C=N/NC(N)=O)c2C)cc1Br,C04739811_decoy,WEE1,Decoy,0.0,-8.03786,-8.46,-0.69,-7.809829370387183
Cc1cc(C)c2cc3c(N)c(C(=O)NCc4ccco4)sc3nc2c1,C01343007_decoy,WEE1,Decoy,0.0,-8.65257,-9.29,-0.4,-7.679024872752052
C[C@@H]1CCc2c(sc3nc([C@@H](C)Sc4nnc(N)s4)[nH]c(=O)c23)C1,C06292347_decoy,WEE1,Decoy,0.0,-11.9081,-9.04,-0.83,-8.81220093081212
Cc1cc(C)c2c(N)c(C(=O)N/N=C/c3ccc(Cl)cc3)sc2n1,C01035457_decoy,WEE1,Decoy,0.0,-8.41511,-8.65,-0.69,-7.0281766833349
Cc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc1Cl,C09142115_decoy,WEE1,Decoy,0.0,-8.88434,-9.56,0.55,-16.587077401345315
CC1(C)CC(=O)C2=C(C1)Nc1[nH]nc(O)c1[C@H]2c1ccc(Br)cc1,C12347872_decoy,WEE1,Decoy,0.0,-7.69343,-8.96,-0.18,-6.855784375067427
O=[N+]([O-])c1cc(O)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14467181_decoy,WEE1,Decoy,0.0,-10.1789,-10.38,-1.62,-9.11241150349454
CC1=C(C(=O)Nc2ccc(Cl)cc2)[C@H](c2cccs2)C(C#N)=C(N)O1,C16606640_decoy,WEE1,Decoy,0.0,-8.50206,-5.11,-0.88,-5.056435302979828
Cc1ccc(S(=O)(=O)Nc2ccc(Br)cc2F)cc1N,C20022039_decoy,WEE1,Decoy,0.0,-8.59182,-8.33,-2.48,-7.724721311573042
Nc1ccc2nc(NC(=O)c3ccc(I)cc3)sc2c1,C20480364_decoy,WEE1,Decoy,0.0,-8.21078,-8.79,0.48,-6.929188455058375
O=[N+]([O-])c1ccc(O)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1cc(Cl)cc(Cl)c1O)N2,C20701260_decoy,WEE1,Decoy,0.0,-8.04918,-5.64,-2.18,-4.8290862254490605
CC(C)(C)[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3c[nH]c4ccccc34)[C@H]2C1,C15218244_decoy,WEE1,Decoy,0.0,-8.71209,-5.42,-0.95,-5.248863249063122
CC1=CC[C@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=C[C@@H]2O,C31161284_decoy,WEE1,Decoy,0.0,-8.88395,-5.35,-2.16,-4.288639825810948
COc1ccc2c(c1O)O[C@H]1c3cc(CC=C(C)C)c(O)c(O)c3OC[C@H]21,C31170046_decoy,WEE1,Decoy,0.0,-10.9271,-10.79,-0.65,-10.722597360864956
Cc1ccc(NC(=O)c2sc3nc(C(F)(F)F)cc(C)c3c2N)cc1,C32117804_decoy,WEE1,Decoy,0.0,-8.27376,-9.26,-0.41,-7.8113614069651875
Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2\CC[C@H]3CCCC[C@H]3C2)c1Cl,C33043977_decoy,WEE1,Decoy,0.0,-9.28322,-8.42,-0.59,-9.621770682504636
CC(C)(C)[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3c[nH]c4ccccc34)[C@@H]2C1,C04149908_decoy,WEE1,Decoy,0.0,-6.61428,-5.11,-0.05,-3.766127016756157
Cc1cccc(N)c1S(=O)(=O)Nc1ccc(Br)cc1F,C35346990_decoy,WEE1,Decoy,0.0,-5.92404,-8.12,-3.74,-4.970446512786461
CC1=C(C(N)=O)[C@@H](c2ccc(F)cc2)N2NC(c3ccc(F)cc3)=NC2=N1,C04279574_decoy,WEE1,Decoy,0.0,-7.57616,-4.93,-2.01,-4.25261475845957
Cc1ccoc1C(=O)Nc1c(N)cc(Br)cc1Br,C36737378_decoy,WEE1,Decoy,0.0,-8.2315,-8.03,0.28,-8.108781868887393
Nc1c(C(=O)NC2CCCCC2)sc(=S)n1C1CCCCC1,C13547198_decoy,WEE1,Decoy,0.0,-9.48075,-8.22,-0.73,-8.27518401264829
Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2Br)ccc1N,C37040277_decoy,WEE1,Decoy,0.0,-7.58929,-9.65,-0.64,-7.887279077564358
Cc1ccc(C(=O)Nc2ccc(Br)cc2[N+](=O)[O-])cc1N,C37042096_decoy,WEE1,Decoy,0.0,-7.13414,-8.9,-0.47,-7.419681142684657
Cc1ccc(N)c(S(=O)(=O)Nc2ccc(F)cc2Cl)c1C,C37064377_decoy,WEE1,Decoy,0.0,-5.97543,-4.42,-3.07,-3.009370433803917
[H]/N=C1/SC(N)=C(C#N)[C@@H](c2ccc(-c3ccccc3)cc2)[C@H]1C#N,C00058554_decoy,WEE1,Decoy,0.0,-8.09041,-4.4,-0.85,-3.6462722802003418
CCCC1=C2[C@@H](c3cc(Br)ccc3O)C(C#N)=C(N)O[C@@H]2N=N1,C39963244_decoy,WEE1,Decoy,0.0,-7.12409,-4.3,-1.93,-3.826255940952644
CC(C)c1ccc([C@H]2C3=C(CC(C)(C)CC3=O)Nc3c(C(N)=O)cnn32)cc1,C40288122_decoy,WEE1,Decoy,0.0,-8.22082,-4.8,-1.09,-4.371001710069143
CN(C)c1ccc(C(=O)Nc2ccc(Br)cc2Cl)cc1N,C40302529_decoy,WEE1,Decoy,0.0,-8.17607,-8.14,-0.55,-7.491268861956411
COc1cc(Br)cc(C)c1NC(=O)c1ccc(Cl)cc1N,C40307622_decoy,WEE1,Decoy,0.0,-7.68204,-6.05,-0.63,-4.807122857717714
Cc1c(F)cccc1NS(=O)(=O)c1ccc(Br)cc1N,C43319912_decoy,WEE1,Decoy,0.0,-8.06823,-8.54,-1.58,-7.712243570490875
CCCc1[nH]nc2c1[C@@H](c1ccc(Br)cc1F)C(C#N)=C(N)O2,C47309293_decoy,WEE1,Decoy,0.0,-7.66607,-4.84,-1.09,-3.936049002318779
CNC(=O)c1ccc(Cl)c(NC(=O)NC23CC4CC(CC(C4)C2)C3)c1,C48503243_decoy,WEE1,Decoy,0.0,-7.44914,-6.06,-1.26,-4.810587730908972
Cc1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c(Br)c1,C48930899_decoy,WEE1,Decoy,0.0,-6.86462,-10.75,-0.12,-12.00503327042911
CC(C)(C)c1[nH]nc2c1[C@H](c1c(F)cccc1F)C(C#N)=C(N)O2,C06781480_decoy,WEE1,Decoy,0.0,-6.79574,-4.86,-0.99,-3.477261167013851
Nc1nc2n(n1)[C@H](c1ccc(F)cc1)C[C@@H](c1ccccc1Cl)N2,C00524899_decoy,WEE1,Decoy,0.0,-7.16268,-5.76,-0.26,-3.7769196190079737
Cc1cc(Br)cc(N)c1NC(=O)c1ccc2c(c1)CCO2,C50891939_decoy,WEE1,Decoy,0.0,-7.83153,-8.97,-0.54,-7.404750245353892
Cc1ccc(-n2c(C)cc([C@@H]3NC(N)=Nc4nc5ccccc5n43)c2C)c(C)c1,C13124387_decoy,WEE1,Decoy,0.0,-8.46117,-5.97,-1.46,-4.746060622963061
Cc1cc(=O)[nH]c2sc(C(=O)c3ccc(Br)cc3)c(N)c12,C16699506_decoy,WEE1,Decoy,0.0,-8.29648,-9.05,-1.11,-7.367251060670844
Cc1ccc(-c2n[nH]c3c2[C@H](c2ccccc2F)C(C#N)=C(N)O3)cc1,C04592494_decoy,WEE1,Decoy,0.0,-8.12815,-5.28,-0.51,-4.904453049439795
Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)c(Br)c1,C50694116_decoy,WEE1,Decoy,0.0,-7.07326,-9.4,-0.63,-7.426096761891299
Cc1cccc([C@@H]2C[C@H](c3ccc(Cl)cc3)N=C3NC(N)=NN32)c1,C13131490_decoy,WEE1,Decoy,0.0,-8.35622,-8.97,-0.44,-10.187720363669651
CCc1ccc([C@H]2C[C@@H](c3ccccc3C)N3N=C(N)NC3=N2)cc1,C13131859_decoy,WEE1,Decoy,0.0,-6.14179,-4.18,-0.69,-2.907018481739505
Nc1nc2n(n1)[C@H](c1ccccc1Cl)C[C@H](c1ccc(F)cc1)N2,C13132295_decoy,WEE1,Decoy,0.0,-7.48716,-5.03,-1.08,-3.6349012423818174
O=C(NNC(=O)C12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2)NC1CCCC1,C65919965_decoy,WEE1,Decoy,0.0,-7.44282,-6.18,-1.58,-4.590477386915294
Cc1c(Br)ccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)c1C,C02841077_decoy,WEE1,Decoy,0.0,-9.18307,-9.29,-3.11,-7.75092795202055
C[C@@H](Sc1nnc(-c2ccc(Cl)cc2Cl)n1N)C(=O)N[C@H](C)c1ccc(F)cc1,C08645049_decoy,WEE1,Decoy,0.0,-9.06263,-8.89,-2.99,-8.312365875285247
COc1c(C)cc(Br)cc1C(=O)NC(=S)Nc1ccc(NC(=O)C(C)C)cc1,C08831417_decoy,WEE1,Decoy,0.0,-9.78147,-7.57,-1.5,-10.578024983199173
Cc1ccc(NC(=O)c2c(C)nc3sc(C(=O)N4CCCC4)c(N)c3c2-c2ccco2)c(C)c1,C09937247_decoy,WEE1,Decoy,0.0,-7.70804,-5.13,-2.18,-4.597909000452821
O=C(NC(=S)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1cc(Cl)cc(Cl)c1,C10505158_decoy,WEE1,Decoy,0.0,-10.6124,-7.57,-3.76,-7.975709182690062
Cc1ccc(-c2nnc(SCC(=O)Nc3c(F)cc(F)cc3Br)n2N)cc1,C10521739_decoy,WEE1,Decoy,0.0,-8.32089,-8.52,-1.24,-12.315746431441362
Nn1c(SCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)nnc1-c1ccccc1F,C02374379_decoy,WEE1,Decoy,0.0,-8.44392,-9.85,-1.77,-9.064332452928344
Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccc(Cl)c2)cc1,C14005141_decoy,WEE1,Decoy,0.0,-9.63037,-9.28,-1.73,-8.49371037870975
CC(C)COc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)c1cccs1,C14667354_decoy,WEE1,Decoy,0.0,-9.70225,-6.96,-2.19,-9.782872863474378
CC[C@H](C)NC(=O)c1cccc(NC(=S)NC(=O)c2cc(Br)ccc2OC)c1,C14836498_decoy,WEE1,Decoy,0.0,-8.80884,-7.46,-3.15,-7.472011589135413
O=C(CC[C@@H]1Cc2ccccc2NC1=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1,C14849231_decoy,WEE1,Decoy,0.0,-9.29456,-6.45,-2.55,-7.128979724283076
COc1cc(C(=O)NNC(=S)Nc2ccc(C(C)C)cc2)cc(OC)c1Br,C15430164_decoy,WEE1,Decoy,0.0,-8.9358,-7.42,-2.63,-8.02784295557723
CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccc(Cl)cc2)C(C#N)=C(SCC(N)=O)N1,C01145028_decoy,WEE1,Decoy,0.0,-8.37139,-7.85,-2.63,-8.18764280845086
COc1ccc([C@H]2Nc3ccc(S(=O)(=O)NC4CCCCC4)cc3[C@@H]3C=CC[C@@H]23)cc1O,C20689968_decoy,WEE1,Decoy,0.0,-9.77745,-6.33,-1.76,-5.403463100130915
Nn1c(SCC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)nnc1C1CCCCC1,C21237980_decoy,WEE1,Decoy,0.0,-8.55326,-8.8,-1.71,-7.93124608651689
C/C(=N\Nc1nnc(SCc2ccc(Cl)cc2)n1N)c1ccc(Br)cc1,C21322972_decoy,WEE1,Decoy,0.0,-8.34203,-8.5,-1.98,-7.574970521763262
CC(C)(C)c1ccccc1NC(=O)CSc1nnc(-c2ccccc2Br)n1N,C22003036_decoy,WEE1,Decoy,0.0,-10.2012,-6.6,-1.03,-7.421126883851826
O=C(Cc1ccccc1)NCC(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1,C22471945_decoy,WEE1,Decoy,0.0,-8.22128,-10.38,-1.2,-10.20015577416361
O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2ccccc2SCc2cscn2)cc1,C23182370_decoy,WEE1,Decoy,0.0,-9.37174,-5.57,-4.52,-5.401030468335642
C[C@@H]1CCc2c(sc3nc(SCC(=O)Nc4ccc5c(c4)OCCCO5)nc(N)c23)C1,C23590743_decoy,WEE1,Decoy,0.0,-9.87238,-9.93,-1.75,-8.731974110867945
COc1cccc2c(C)cc(SCCC(=O)Nc3sc4c(c3C(N)=O)CCCC4)nc12,C32530212_decoy,WEE1,Decoy,0.0,-8.83251,-8.73,-1.1,-8.852383804005973
O=C(Nc1ccc(F)c(F)c1)Nc1ccc(N2CCc3ccccc3C2)c(C(=O)NC2CC2)c1,C35723136_decoy,WEE1,Decoy,0.0,-8.78692,-10.32,-2.13,-8.884926998111883
COc1ccc(C23C[C@@H]4C[C@@H](CC(C(=O)NCCc5ccc(S(N)(=O)=O)cc5)(C4)C2)C3)cc1,C18058732_decoy,WEE1,Decoy,0.0,-10.0803,-8.12,-4.63,-7.96535787212195
COc1ccc(Br)cc1C(=O)NC(=S)Nc1cccc(NC(=O)C2CC2)c1C,C36568497_decoy,WEE1,Decoy,0.0,-8.43607,-8.32,-5.03,-8.231335825148182
C[C@H](O)c1ccc(NC(=O)C2=C(Br)C3=N[C@H](c4cccs4)C[C@H](C(F)(F)F)N3N2)cc1,C00675051_decoy,WEE1,Decoy,0.0,-9.16159,-7.29,-1.37,-7.0012049651720565
O=C1C=C/C(=C2\Nc3cc(NC(=S)NC(=O)c4ccc(F)cc4)ccc3O2)C=C1Br,C32116806_decoy,WEE1,Decoy,0.0,-8.52154,-9.46,-2.13,-6.797087814937547
N#C/C(=C\c1ccc(-c2ccc(Cl)cc2)o1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2,C39884976_decoy,WEE1,Decoy,0.0,-9.56837,-9.25,-1.51,-7.636543997449526
Cc1ccccc1NC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)Nc2ccccc2C)[C@H]1c1cccs1,C41006390_decoy,WEE1,Decoy,0.0,-8.96694,-4.91,-3.87,-5.403220701456787
C[C@]1(O)CC(=O)[C@@H](C(=O)Nc2ccccc2)[C@H](/C=C/c2ccccc2)[C@@H]1C(=O)Nc1ccccc1,C41006712_decoy,WEE1,Decoy,0.0,-8.17427,-5.86,-5.06,-5.856657645454382
COC(=O)c1ccc([C@H]2NC(=S)NC(C)=C2C(=O)Nc2ccc(Br)cc2)cc1,C45326786_decoy,WEE1,Decoy,0.0,-8.3838,-5.6,-3.57,-6.101062840085716
C[C@H](O)c1ccc(NC(=O)c2nn3c(c2Cl)N[C@@H](c2cccs2)C[C@@H]3C(F)(F)F)cc1,C08444533_decoy,WEE1,Decoy,0.0,-8.99162,-9.85,-1.58,-8.071982068539441
CCCOc1ccc(-c2n[nH]c3c2[C@@H](c2ccc(Br)cc2)C(C#N)=C(N)O3)cc1,C09242496_decoy,WEE1,Decoy,0.0,-8.9417,-5.48,0.25,-5.879905755530907
N#CC1=C(N)Oc2cc(O)c(/C=N/c3cc(C(F)(F)F)ccc3Cl)cc2[C@@H]1c1ccco1,C00711715_decoy,WEE1,Decoy,0.0,-9.53486,-6.41,-1.42,-5.85454560941035
CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2[nH]nc(-c3ccc(Br)cc3)c21,C08854870_decoy,WEE1,Decoy,0.0,-4.95368,-5.18,-2.15,-3.427357631556318
N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)cc3)c2[C@H]1c1ccc(OCc2ccccc2)cc1,C00623033_decoy,WEE1,Decoy,0.0,-8.50288,-8.82,-3.0,-8.625450777148863
CC[NH+](CC)c1ccc([C@H]2C3=C(CC(C)(C)CC3=O)Nc3[nH]n(-c4ccccc4)c(=O)c32)cc1,C12347065_decoy,WEE1,Decoy,0.0,-8.49683,-5.27,-1.65,-4.737195507689097
N/C(=N\C(=O)c1ccccc1)[C@H]1C(=O)N(c2ccccc2)N[C@H]1CSc1ccc(Cl)cc1,C58867739_decoy,WEE1,Decoy,0.0,-9.33529,-10.13,-2.97,-9.761911031581164
N/C(=N\C(=O)c1ccccc1)[C@H]1C(=O)N(c2ccccc2)N[C@@H]1CSc1ccc(Cl)cc1,C58867744_decoy,WEE1,Decoy,0.0,-8.94492,-9.95,-1.81,-10.649735841742476
CC[C@H](NC(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1OC(F)F,C59037844_decoy,WEE1,Decoy,0.0,-8.61304,-7.16,-3.07,-6.53099347346579
Nn1c(SCC(=O)NC2C3CC4CC(C3)CC2C4)nnc1-c1cccc(Br)c1,C59044563_decoy,WEE1,Decoy,0.0,-10.3077,-8.66,-4.09,-10.585751734319206
CCSc1ccccc1NC(=O)CSc1nnc(-c2ccc(Br)cc2)n1N,C59045348_decoy,WEE1,Decoy,0.0,-8.9707,-8.01,-1.74,-8.371967802124134
Nn1c(SCCC(=O)Nc2ccc(Br)cc2)nnc1-c1ccc(Br)cc1,C59265090_decoy,WEE1,Decoy,0.0,-10.4192,-9.3,-3.92,-9.4759459748749
CCCNC(=O)C1=c2s/c(=C/c3ccc(C)cc3)c(=O)n2C(N)=C(C#N)[C@@H]1c1ccc(C)cc1,C59293545_decoy,WEE1,Decoy,0.0,-6.59111,-5.09,-1.51,-4.5694814031556765
CC(C)C[C@H](NC(=O)[C@@H](C)NC(=O)c1ccc(Br)s1)c1nc2ccccc2[nH]1,C59363683_decoy,WEE1,Decoy,0.0,-9.3941,-7.61,-2.78,-8.485276432548245
CC1=C(C(=O)N/N=C/c2ccc(N(C)C)cc2)[C@H](c2ccc(Cl)cc2Cl)NC(=S)N1,C59384959_decoy,WEE1,Decoy,0.0,-10.7093,-5.55,-1.83,-6.77598812840341
COc1ccc(C(=O)NC(=S)Nc2ccc(NC(=O)c3ccccc3)c(C)c2)cc1Cl,C59438618_decoy,WEE1,Decoy,0.0,-8.43062,-9.57,-3.46,-8.73291480623496
COc1cc(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)c(C(N)=O)cc1OC,C60204830_decoy,WEE1,Decoy,0.0,-9.53033,-9.09,-2.11,-8.387230900740178
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1(c2ccc(Br)cc2)CCCC1,C62626023_decoy,WEE1,Decoy,0.0,-9.58638,-8.34,-2.86,-7.799761375989711
CC[C@H](C)NC(=O)/C=C(\C)NNC(=O)COc1cc(C)c(Br)cc1Br,C33615453_decoy,WEE1,Decoy,0.0,-9.64626,-8.21,-2.11,-8.999850342900404
CC(=O)Nc1cc(NC(=S)NC(=O)c2cc(Br)ccc2OC(C)C)ccc1C,C66185281_decoy,WEE1,Decoy,0.0,-9.98624,-7.71,-3.97,-7.633737344490504
O=C(c1ccc(N2CCC([NH2+]Cc3cc(C(F)(F)F)ccc3F)CC2)cc1)N1CCC[C@@H](CO)C1,C12099555_decoy,WEE1,Decoy,0.0,-9.6307,-7.83,-3.66,-7.185871279623683
CC[NH+](CC(=O)NCC(=O)Nc1c(C)cc(C)cc1C)Cc1ccc(Br)s1,C20814955_decoy,WEE1,Decoy,0.0,-8.55133,-7.59,-2.0,-7.421307688107456
NC(=O)CCN(C(=O)C[NH+]1CCc2sccc2[C@H]1c1cccs1)c1ccc(F)cc1,C32774583_decoy,WEE1,Decoy,0.0,-9.90584,-7.52,-3.16,-8.195248598044518
CNC(=O)C1=C(C)[NH+]=C2SCCCN2[C@@H]1c1ccc(NC(=O)/C=C/c2ccccc2)cc1,C35337739_decoy,WEE1,Decoy,0.0,-7.06582,-7.13,-1.55,-5.758445531126669
CC[C@H](C)CNC(=O)[C@@H]1CSC2(CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)[NH2+]1,C35374416_decoy,WEE1,Decoy,0.0,-9.72609,-6.01,-4.27,-6.523214042782184
CC[C@@H](C)CNC(=O)[C@H]1CSC2(CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)[NH2+]1,C35374418_decoy,WEE1,Decoy,0.0,-9.13767,-5.37,-2.07,-6.279043429648072
CCCC[C@@H](C)C(=O)N1C[C@H](C(=O)NCc2cc(Br)ccc2F)C2(CC[NH2+]CC2)C1,C39600880_decoy,WEE1,Decoy,0.0,-8.26039,-8.48,-3.6,-7.942909147510755
CC[C@H](C(=O)N1C[C@H](C(=O)N[C@H]2C[C@@H]2c2ccccc2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39602348_decoy,WEE1,Decoy,0.0,-8.3756,-8.73,-1.65,-7.774437184175685
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3F)CC23CC[NH2+]CC3)cc1C,C39609212_decoy,WEE1,Decoy,0.0,-8.50999,-6.92,-4.51,-5.004348776214163
Cc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3F)CC23CC[NH2+]CC3)cc1C,C39609213_decoy,WEE1,Decoy,0.0,-7.84853,-7.72,-2.9,-4.70881720787445
Cc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)c(F)c3)CC23CC[NH2+]CC3)cc1C,C39609217_decoy,WEE1,Decoy,0.0,-8.69865,-8.59,-3.27,-7.617985596849631
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(Br)c(C)c3)CC23CC[NH2+]CC3)cc1C,C39609258_decoy,WEE1,Decoy,0.0,-9.5836,-10.09,-2.48,-7.711241417904746
O=C(NC1CCCCCC1)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2F)CC12CC[NH2+]CC2,C39633449_decoy,WEE1,Decoy,0.0,-8.30824,-5.96,-2.33,-5.454434803046985
C[C@@H]1[C@H](C)CCC[C@@H]1NC(=O)[C@@H]1CN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39637225_decoy,WEE1,Decoy,0.0,-8.03494,-5.79,-2.62,-5.461869695495616
C[C@@H]1[C@H](C)CCC[C@H]1NC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39637231_decoy,WEE1,Decoy,0.0,-9.35845,-5.48,-4.4,-5.131079943967416
C[C@@H]1[C@@H](C)CCC[C@H]1NC(=O)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c(F)c2)CC12CC[NH2+]CC2,C39637232_decoy,WEE1,Decoy,0.0,-8.95966,-7.98,-0.72,-7.804748696776821
C[C@H]1[C@@H](NC(=O)[C@@H]2CN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC23CC[NH2+]CC3)CCC[C@@H]1C,C39637234_decoy,WEE1,Decoy,0.0,-7.51315,-5.98,-4.95,-4.757161388173524
CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCCc2ccc(Br)cc2)C2(CC[NH2+]CC2)C1,C39652835_decoy,WEE1,Decoy,0.0,-9.63411,-8.45,-3.56,-9.381099346541282
O=C(NCCc1ccc(Br)cc1)[C@H]1CN(C(=O)CCC2CCCC2)CC12CC[NH2+]CC2,C39652855_decoy,WEE1,Decoy,0.0,-9.14549,-9.68,-1.66,-5.911275335322019
C[C@H](NC(=O)[C@H]1CN(C(=O)c2ccc3ccccc3c2)CC12CC[NH2+]CC2)c1ccc(Br)cc1,C39656831_decoy,WEE1,Decoy,0.0,-9.37956,-7.28,-1.7,-6.924728698051093
C[C@H](NC(=O)[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)CC12CC[NH2+]CC2)c1ccc(Br)cc1,C39656934_decoy,WEE1,Decoy,0.0,-9.71938,-7.68,-0.76,-7.939359589247432
Cc1ccc(F)c(C(=O)N2C[C@H](C(=O)N[C@@H](C)c3ccc(Br)cc3)C3(CC[NH2+]CC3)C2)c1F,C39656983_decoy,WEE1,Decoy,0.0,-9.14287,-7.98,-2.48,-7.467573020997868
C[C@@H](NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2F)CC12CC[NH2+]CC2)c1ccc(Br)cc1,C39656999_decoy,WEE1,Decoy,0.0,-10.525,-8.97,-1.61,-8.946893194641953
C[C@@H](NC(=O)[C@@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2)c1ccc(Br)cc1,C39657124_decoy,WEE1,Decoy,0.0,-10.2165,-5.36,-1.49,-7.130037379744989
C[C@@H](NC(=O)[C@H]1CN(C(=O)c2csc3ccccc23)CC12CC[NH2+]CC2)c1ccc(Br)cc1,C39657127_decoy,WEE1,Decoy,0.0,-10.1363,-5.64,-3.89,-5.662203756317505
CC[C@H](C)CC(=O)N1C[C@H](C(=O)N[C@@H](C)c2ccc(Br)cc2)C2(CC[NH2+]CC2)C1,C39657144_decoy,WEE1,Decoy,0.0,-9.40034,-7.52,-1.39,-8.219765958965098
CC[C@H](C)CC(=O)N1C[C@@H](C(=O)N[C@@H](C)c2ccc(Br)cc2)C2(CC[NH2+]CC2)C1,C39657147_decoy,WEE1,Decoy,0.0,-9.23728,-5.25,-4.11,-6.850012050517812
Cc1ccsc1C(=O)N1C[C@H](C(=O)N[C@@H](C)c2ccc(Br)cc2)C2(CC[NH2+]CC2)C1,C39657178_decoy,WEE1,Decoy,0.0,-9.05409,-8.32,-2.91,-7.421832909861741
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)c(C)c1,C39666969_decoy,WEE1,Decoy,0.0,-7.05078,-10.68,-2.69,-8.045946909266341
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3cc(F)cc(C(F)(F)F)c3)CC23CC[NH2+]CC3)c(C)c1,C39667017_decoy,WEE1,Decoy,0.0,-7.14194,-10.31,-3.76,-7.709829774044209
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(Br)cc3)CC23CC[NH2+]CC3)c(C)c1,C39667032_decoy,WEE1,Decoy,0.0,-7.24818,-5.94,-3.36,-4.355068206226919
Cc1ccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(Br)c(C)c3)CC23CC[NH2+]CC3)c(C)c1,C39667068_decoy,WEE1,Decoy,0.0,-9.65664,-8.42,-2.05,-8.486316446385743
Cc1ccc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(C)c(C)c3)CC23CC[NH2+]CC3)c(C)c1,C39667112_decoy,WEE1,Decoy,0.0,-8.61837,-10.12,-3.09,-10.107387358813652
Cc1cc(C(=O)N2C[C@H](C(=O)NCc3cccc(C)c3C)C3(CC[NH2+]CC3)C2)ccc1Br,C39667559_decoy,WEE1,Decoy,0.0,-9.1469,-10.11,-4.0,-9.101977241154128
Cc1ccc(C)c(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)c1,C39676895_decoy,WEE1,Decoy,0.0,-7.88298,-8.45,-2.24,-7.422983480036494
CCc1ccc(C(=O)N2C[C@H](C(=O)NCCc3cc(C)ccc3C)C3(CC[NH2+]CC3)C2)cc1,C39676912_decoy,WEE1,Decoy,0.0,-7.69537,-10.8,-2.38,-10.493565496843742
Cc1ccc(C(=O)N2C[C@@H](C(=O)NCCc3cc(C)ccc3C)C3(CC[NH2+]CC3)C2)c(C)c1,C39677059_decoy,WEE1,Decoy,0.0,-7.33253,-10.18,-2.96,-8.16448435275218
Cc1ccc(C)c(CCNC(=O)[C@@H]2CN(C(=O)c3c(F)ccc(Cl)c3F)CC23CC[NH2+]CC3)c1,C39677104_decoy,WEE1,Decoy,0.0,-8.09616,-9.09,-1.76,-7.546401280581212
CCC[C@@H](C)C(=O)N1C[C@@H](C(=O)NCCc2ccccc2Br)C2(CC[NH2+]CC2)C1,C39683639_decoy,WEE1,Decoy,0.0,-8.485,-5.98,-2.02,-5.270293540984876
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)Cc3ccccc3F)C3(CC[NH2+]CC3)C2)ccc1Br,C39686999_decoy,WEE1,Decoy,0.0,-9.83069,-6.41,-3.14,-6.327954857514811
Cc1cc(C(=O)N2C[C@@H](C(=O)N[C@H](C)Cc3ccc(F)cc3)C3(CC[NH2+]CC3)C2)ccc1Br,C39688581_decoy,WEE1,Decoy,0.0,-9.65533,-6.6,-3.27,-6.410458426796444
Cc1cc(C(=O)N2C[C@@H](C(=O)NCCc3ccccc3C)C3(CC[NH2+]CC3)C2)ccc1Br,C39691162_decoy,WEE1,Decoy,0.0,-7.64108,-10.16,-2.99,-8.730854815073062
CCc1ccc([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3cc(F)ccc3C)CC23CC[NH2+]CC3)cc1,C39696162_decoy,WEE1,Decoy,0.0,-7.80806,-6.29,-2.19,-5.805387276123724
COc1ccc(OC)c(NC(=S)N(Cc2cccs2)C2CC(C)(C)[NH2+]C(C)(C)C2)c1,C59092646_decoy,WEE1,Decoy,0.0,-8.9299,-7.77,-2.04,-9.940097215399184
COc1ccccc1CN(C(=S)Nc1ccc(C(C)=O)cc1)C1CC(C)(C)[NH2+]C(C)(C)C1,C59169078_decoy,WEE1,Decoy,0.0,-7.79564,-6.89,-2.88,-6.102532276673564
Cc1ccccc1C[C@@H](C)NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1cccs1,C64117481_decoy,WEE1,Decoy,0.0,-8.92943,-9.25,-1.03,-11.680901683289123
Cc1ccccc1C[C@H](C)NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)c1cccs1,C64117483_decoy,WEE1,Decoy,0.0,-9.54298,-8.17,-2.51,-10.89675413446516
O=C(/C=C1/CS[C@@H](SCC(=O)c2cccs2)N1)NCCC1=c2ccccc2=[NH+]C1,C64661442_decoy,WEE1,Decoy,0.0,-10.5481,-7.86,-1.49,-8.787428843312831
Cc1cccc(CNC2=[NH+]CCNC23CCN(S(=O)(=O)c2ccc(Cl)s2)CC3)c1,C65074785_decoy,WEE1,Decoy,0.0,-9.76682,-8.6,-1.78,-9.564925460953562
Cc1ccc(CNC2=[NH+]CCNC23CCN(S(=O)(=O)c2ccc(C)cc2C)CC3)cc1,C65074807_decoy,WEE1,Decoy,0.0,-8.80411,-10.31,-3.8,-12.10707455958769
Cc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccc(Br)o3)cc2)cc1C,C01113292_decoy,WEE1,Decoy,0.0,-10.9602,-7.8,-2.62,-9.276930304001844
C[C@@H]1CCc2c(sc(NC(=O)CSc3nnc(Cc4cccs4)n3C3CC3)c2C(N)=O)C1,C08735181_decoy,WEE1,Decoy,0.0,-9.9869,-8.75,-3.03,-8.537045242465153
O=C(CSc1nnc(NC(=O)Nc2ccc(Cl)cc2)s1)Nc1nc2ccccc2s1,C09324312_decoy,WEE1,Decoy,0.0,-9.96707,-5.84,-4.92,-6.4349764707768085
COc1cc(OC)c(NC(=O)c2ccc(N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(N)c2)cc1Cl,C09490179_decoy,WEE1,Decoy,0.0,-10.0778,-8.11,-3.6,-7.4601135806887635
CC(C)[C@H](NC(=O)c1ccco1)C(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1,C09791231_decoy,WEE1,Decoy,0.0,-8.28128,-9.9,-2.21,-8.164337233132668
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3)sc2c1,C09714928_decoy,WEE1,Decoy,0.0,-9.15207,-9.45,-1.32,-7.63500278153526
COc1ccc2cc(C)c3nnc(SCC(=O)Nc4sc5c(c4C(N)=O)CCCC5)n3c2c1,C12470086_decoy,WEE1,Decoy,0.0,-8.40933,-9.66,-2.59,-8.253433504119142
Cc1ccc(C(=O)NC(=S)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1I,C13977104_decoy,WEE1,Decoy,0.0,-8.34616,-9.39,-0.89,-9.65768741406899
COc1ccc(/C=C/C(=O)NC(=S)NNC(=O)c2ccc(C)c(Br)c2)cc1OC,C13977395_decoy,WEE1,Decoy,0.0,-10.0575,-7.03,-1.51,-9.528919314767563
CNC(=S)/N=C(/Nc1nc(C)cc(C)n1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1,C14160370_decoy,WEE1,Decoy,0.0,-9.14,-5.96,-2.79,-5.864270000761283
CNS(=O)(=O)c1cc(NCc2cccc3cccnc23)cc(C(=O)Nc2cccc(SC)c2)c1,C14535699_decoy,WEE1,Decoy,0.0,-10.8965,-10.16,-3.5,-11.977679496048417
COc1ccc(C(=O)NC(=S)NNC(=O)COc2cccc(C)c2C)cc1I,C14649024_decoy,WEE1,Decoy,0.0,-9.49141,-7.25,-3.29,-6.969144863458014
CNS(=O)(=O)c1cc(NCc2cc3ccccc3s2)cc(C(=O)Nc2ccc(OC)cc2)c1,C14742864_decoy,WEE1,Decoy,0.0,-10.4367,-10.07,-2.61,-11.377335001244296
CCOC(=O)c1c(NC(=O)[C@@H](Sc2nnc(N)s2)c2ccccc2)sc2c1CC[C@@H](C)C2,C15156285_decoy,WEE1,Decoy,0.0,-10.3641,-7.87,-1.81,-8.612785075377312
O=C(NNC(=S)NC1CCCCC1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1,C15874291_decoy,WEE1,Decoy,0.0,-9.19487,-8.07,-4.11,-6.979254356873329
CC(C)c1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)c2)cc1,C15885943_decoy,WEE1,Decoy,0.0,-9.64275,-7.69,-2.63,-10.725816715252986
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(SC(F)F)cc2)c1)c1ccccc1,C17171072_decoy,WEE1,Decoy,0.0,-9.45832,-8.83,-3.44,-8.518164966707195
CCC1CCC2(CC1)NC(=O)N(CC(=O)NCC(=O)Nc1ccc(Br)cc1C)C2=O,C17958529_decoy,WEE1,Decoy,0.0,-8.68515,-8.93,-1.01,-7.401474519646685
NC(=O)c1c(NC(=O)c2cc3nc(-c4ccco4)cc(C(F)(F)F)n3n2)sc2c1CCCCC2,C00995802_decoy,WEE1,Decoy,0.0,-8.96458,-8.37,-1.64,-7.3171947180688335
CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2ccc(F)cc2)N1,C09375412_decoy,WEE1,Decoy,0.0,-9.52402,-8.94,-2.13,-7.660030405407264
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccco2)C(C#N)=C(SCC(=O)NCc2ccccc2)N1,C09076388_decoy,WEE1,Decoy,0.0,-9.35415,-9.78,-3.93,-8.86238026834122
CC1=C(C(=O)Nc2c(C)cccc2C)[C@@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2cccc(C)c2)N1,C20347498_decoy,WEE1,Decoy,0.0,-7.90423,-8.07,-3.71,-6.650072181908137
Cc1ccc(NC(=S)Nc2cc(C(=O)NC3CC3)ccc2N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1C,C03045911_decoy,WEE1,Decoy,0.0,-9.69904,-9.16,-3.43,-10.071302844436032
CC(C)CCn1c(SCC(=O)Nc2sccc2C(N)=O)nc2sc3c(c2c1=O)CCCC3,C20919834_decoy,WEE1,Decoy,0.0,-10.7395,-8.14,-1.37,-8.503032642492707
Cc1ccc(C(C)C)c(OCc2nnc(S[C@@H](C)C(=O)N[C@@H]3CCCc4ccccc43)n2N)c1,C23328350_decoy,WEE1,Decoy,0.0,-9.06378,-8.5,-2.37,-8.893085142986335
Cc1ccc(C(C)C)c(OCc2nnc(S[C@H](C)C(=O)N[C@@H]3CCCc4ccccc43)n2N)c1,C23328354_decoy,WEE1,Decoy,0.0,-8.63884,-7.76,-3.29,-6.519771724077202
CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1,C26062032_decoy,WEE1,Decoy,0.0,-9.90059,-9.35,-4.42,-6.100545730439622
C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1,C27199722_decoy,WEE1,Decoy,0.0,-8.64987,-8.88,-3.61,-6.655901678968108
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N[C@@H](C)c3ccc(NC(=O)C4CC4)cc3)cc2)cc1C,C31399412_decoy,WEE1,Decoy,0.0,-8.1321,-9.46,-2.19,-9.830006815685929
C=CCNC(=O)Nc1ccc(NC(=O)c2ccccc2SCC(=O)N2CCc3ccccc32)cc1,C32938687_decoy,WEE1,Decoy,0.0,-9.14023,-8.74,-2.9,-7.853123997210439
CC(C)[C@@H](NC(=O)Nc1ccccc1Br)C(=O)N1CCC2(CC1)C(=O)NCN2c1ccccc1,C34942116_decoy,WEE1,Decoy,0.0,-8.28479,-6.42,-4.15,-6.342190681299635
CC[C@@H](C)[C@H](NC(=O)NC12CC3CC(CC(C3)C1)C2)C(=O)N1CCN(C(=O)NC(C)C)[C@H](C)C1,C35004422_decoy,WEE1,Decoy,0.0,-8.05938,-4.25,-5.26,-5.080539835582763
O=C(N[C@H](NC(=S)Nc1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl)c1ccc(Cl)cc1,C35022863_decoy,WEE1,Decoy,0.0,-7.93929,-7.68,-1.65,-7.743904334633222
Cc1ccc(CN(C(=O)c2c(O)cccc2O)[C@H](C(=O)NC(C)(C)C)c2ccc(C(F)(F)F)cc2)o1,C36597478_decoy,WEE1,Decoy,0.0,-6.92844,-5.44,-1.5,-4.264635028330114
COc1ccc(CCNC(=O)CSc2nc(N)c3c4c(sc3n2)C[C@H](C)CC4)cc1OC,C36821455_decoy,WEE1,Decoy,0.0,-10.6007,-8.95,-0.69,-9.663055318952647
Cc1c(C(N)=O)sc(NC(=O)CSc2nnc(-c3csc4c3CCCCC4)n2C)c1C#N,C39966335_decoy,WEE1,Decoy,0.0,-9.02577,-8.35,-2.48,-6.907417723051135
CCC(=O)Nc1cccc(NC(=S)Nc2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)c1,C39974628_decoy,WEE1,Decoy,0.0,-11.2935,-8.91,-2.96,-8.533816376373341
Cc1ccc(OC[C@@H](O)CNc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@@H](C)C3)c(C)c1,C40315491_decoy,WEE1,Decoy,0.0,-9.73592,-9.16,-2.72,-9.57477394354706
Cc1cc(C)cc(OC[C@H](O)CNc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@H](C)C3)c1,C40317537_decoy,WEE1,Decoy,0.0,-10.0956,-9.21,-2.98,-9.057105312543596
Nc1nnc(SCC(=O)N/N=C\c2ccc(OCc3ccc(Br)cc3)cc2)s1,C40947240_decoy,WEE1,Decoy,0.0,-9.79937,-7.5,-2.81,-9.033828380328142
Cc1ccc(COc2ccc(Br)cc2/C=N\NC(=O)CSc2nnc(N)s2)cc1,C40947305_decoy,WEE1,Decoy,0.0,-7.78892,-7.74,-1.2,-7.931752106540166
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1sccc1C(N)=O,C45795450_decoy,WEE1,Decoy,0.0,-10.3717,-8.71,-1.5,-10.68521551298553
C[C@H]1Oc2ccccc2O[C@H]1C(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1,C45829555_decoy,WEE1,Decoy,0.0,-8.84501,-5.82,-0.78,-4.79821202755674
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1,C46621178_decoy,WEE1,Decoy,0.0,-8.60087,-9.56,-1.64,-6.738754652979449
O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1,C46621258_decoy,WEE1,Decoy,0.0,-9.43749,-8.85,-1.68,-7.100750666186825
C[C@@H](NC(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1)c1cccc(NC(=O)c2ccccc2)c1,C46777310_decoy,WEE1,Decoy,0.0,-9.44877,-10.22,-3.69,-10.135598063848647
O=C(Nc1cccc(C(F)(F)F)c1)O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2NC(=S)NC1CCCCC1,C04235383_decoy,WEE1,Decoy,0.0,-6.588,-6.89,-3.34,-6.235245365905164
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)Nc1ccc(C(F)(F)F)cc1,C59015564_decoy,WEE1,Decoy,0.0,-9.1914,-7.88,-1.38,-7.652183879097151
Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3NC(=O)NC(C)C)CC2)c(C)c1,C59017594_decoy,WEE1,Decoy,0.0,-8.91494,-9.4,-4.1,-8.162631194065627
CC1CCN(C(=O)c2ccc(NC(=O)CNc3cccc(C(=O)N[C@H](C)c4ccccc4)c3)cc2)CC1,C66096992_decoy,WEE1,Decoy,0.0,-9.31214,-8.39,-3.39,-8.119727306248764
Cc1cc(C)c2c(N)c(C(=O)N3CCCC[C@@H]3C)sc2n1,C00907322_decoy,WEE1,Decoy,0.0,-7.52883,-8.21,-0.67,-6.465788230859053
Cc1ccc(NC(=O)Nc2nc3c(s2)C[C@H](C)CC3)cc1,C02764155_decoy,WEE1,Decoy,0.0,-6.99006,-6.74,0.15,-7.906075259992187
CC(C)(C)c1ccc([C@H]2CC(=O)c3cnc(N)nc3C2)cc1,C00106530_decoy,WEE1,Decoy,0.0,-7.97728,-6.81,-0.79,-6.427872082138056
Cc1coc2c1[C@@H](NC(=O)Nc1ccc(Cl)cc1)CCC2,C00544009_decoy,WEE1,Decoy,0.0,-7.52273,-5.57,-1.96,-4.824252349352634
NC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cccc(Br)c1,C10255673_decoy,WEE1,Decoy,0.0,-7.19392,-8.75,-0.59,-8.684658775745385
Cc1cc(C)c2c(N)c(C(=O)N3CCC[C@H](C)C3)sc2n1,C00422114_decoy,WEE1,Decoy,0.0,-7.33748,-5.32,-1.23,-3.7851359671223337
COc1cc([C@@H]2Nc3ccc(C#N)cc3[C@H]3C=CC[C@@H]32)ccc1O,C14458931_decoy,WEE1,Decoy,0.0,-7.50531,-8.41,-1.37,-5.619577026722575
Nc1cc(Br)ccc1Oc1ccc2c(c1)OCO2,C19845924_decoy,WEE1,Decoy,0.0,-7.71813,-8.18,-0.47,-7.278560762466124
C/C(=N/N=c1\sc2ccccc2n1C)c1cccc(N)c1,C19909684_decoy,WEE1,Decoy,0.0,-7.68948,-8.1,-0.81,-10.817907284248154
Cc1c(N)cccc1S(=O)(=O)N1c2ccccc2C[C@H]1C,C20021216_decoy,WEE1,Decoy,0.0,-7.03819,-8.29,-1.44,-8.059460284197563
N#CC1=C(N)C(C#N)(C#N)[C@H]([C@H]2C=CCCC2)[C@@H]2CCCC=C12,C20058168_decoy,WEE1,Decoy,0.0,-7.9486,-6.88,-1.6,-4.061516340995735
C[C@@H]1CCc2ccccc2N1S(=O)(=O)c1ccc(N)cc1,C21014344_decoy,WEE1,Decoy,0.0,-7.20372,-6.56,-1.53,-6.552656334134255
Cc1cc(S(=O)(=O)N2CCCCCCC2)cc(N)c1C,C21050860_decoy,WEE1,Decoy,0.0,-6.31781,-7.45,-3.48,-6.490515543775199
C[C@@H]1CCC[C@H](C)N1S(=O)(=O)c1ccc(Cl)cc1N,C21816263_decoy,WEE1,Decoy,0.0,-7.32302,-8.4,-3.21,-7.78216977368974
Cc1c(N)ccc2nnc(-c3cccc(Br)c3)n12,C36252543_decoy,WEE1,Decoy,0.0,-7.96145,-8.37,-0.96,-6.625777975834659
Cc1ccc(-c2nc3scc(-c4ccccn4)n3c2N)cc1,C36290464_decoy,WEE1,Decoy,0.0,-8.1787,-9.0,-0.25,-11.052962387236828
Cc1nc(N)c2c(C)c(C)n(-c3ccc(F)cc3Cl)c2n1,C37352982_decoy,WEE1,Decoy,0.0,-8.04654,-6.92,-0.25,-5.799443937227881
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cc(Cl)ccc2N)C1,C37928940_decoy,WEE1,Decoy,0.0,-8.39604,-7.84,-4.62,-5.784476768567593
Nc1ccc(F)cc1S(=O)(=O)N1CC[C@@H]2CCCC[C@@H]2C1,C37929844_decoy,WEE1,Decoy,0.0,-7.2174,-4.18,-3.84,-3.781419489205285
C[C@@H]1SC(NC2CCCCC2)=NN/C1=C1/C=Nc2ccccc21,C07779856_decoy,WEE1,Decoy,0.0,-9.33842,-8.01,-1.58,-6.779529996118909
Cc1cc(O)n([C@H]2N[C@H](c3ccc(Br)cc3)CS2)n1,C39408497_decoy,WEE1,Decoy,0.0,-8.09355,-4.8,-1.33,-3.721673468071496
Cc1ccc(NC(=O)[C@@]23CC[C@@](C)(/C(=N/O)C2)C3(C)C)cc1C,C33960366_decoy,WEE1,Decoy,0.0,-8.17691,-6.67,-1.21,-5.146695895733121
Cc1nnc(N2CCCc3ccccc32)c(C(N)=S)c1C,C40291045_decoy,WEE1,Decoy,0.0,-7.69064,-4.7,-0.46,-3.589096323283002
Cc1cc(I)ccc1NC(=O)c1c(C)n[nH]c1C,C40828883_decoy,WEE1,Decoy,0.0,-7.43126,-7.5,-2.08,-7.472785393442077
N[C@@H](c1cc(Cl)c2c(c1)OCCO2)c1nc2c(s1)CCC2,C41183667_decoy,WEE1,Decoy,0.0,-9.05145,-7.59,-2.32,-7.296162139876574
O=C(Nc1cccc2cn[nH]c12)C1C2CC3CC(C2)CC1C3,C42649485_decoy,WEE1,Decoy,0.0,-7.789,-8.48,-2.06,-6.612683300199262
Nc1ccsc1-c1nc(-c2cc(F)c(F)c(F)c2)no1,C43391717_decoy,WEE1,Decoy,0.0,-7.5281,-7.8,-0.93,-6.472318089144654
Brc1cnc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4[NH2+]3)[n-]c2c1,C43460889_decoy,WEE1,Decoy,0.0,-7.22351,-6.19,-0.81,-4.930014334451119
Cc1cc(Br)c(O)c(C(=O)NC2=NCCS2)c1,C47827105_decoy,WEE1,Decoy,0.0,-8.00804,-4.8,-1.51,-4.242576631068767
Cc1n[nH]c(C(=O)N[C@H]2CCC[C@@H](C)[C@@H]2C)c1Br,C48889317_decoy,WEE1,Decoy,0.0,-7.77964,-7.41,-0.56,-7.393709958571942
O=C(Nc1cccc(Br)n1)c1ccc2cc[nH]c2c1,C49424220_decoy,WEE1,Decoy,0.0,-7.66976,-8.93,-1.32,-9.90408870390458
O=C(Nc1ccc2c(c1)C1(CCCCC1)C(=O)N2)C1CCC1,C49741019_decoy,WEE1,Decoy,0.0,-7.82885,-5.47,-0.26,-4.557243926730936
O=C(Nc1ccc2c(c1)C1(CCCC1)C(=O)N2)C1CCCC1,C49741062_decoy,WEE1,Decoy,0.0,-7.62922,-6.28,0.3,-6.740365565075874
CC(C)(C)C1CCN(C(=O)c2cc(Br)cnc2N)CC1,C50705299_decoy,WEE1,Decoy,0.0,-7.35662,-5.04,-1.08,-4.001562481321198
O=c1[nH]c2cc(Br)c([C@H](Cl)[C@H]3CCOC3)cc2[nH]1,C52095085_decoy,WEE1,Decoy,0.0,-7.86706,-6.45,-1.02,-6.48368639341019
C[C@H]1c2ccccc2S[C@H]1C(=O)N=c1[nH]c2ccccc2[nH]1,C39446762_decoy,WEE1,Decoy,0.0,-8.89222,-8.49,-0.72,-7.673199587490592
Cc1nc(N)sc1C(=O)N(C)C1C2CC3CC(C2)CC1C3,C55173674_decoy,WEE1,Decoy,0.0,-6.62915,-7.0,-2.27,-6.425696072070175
Nc1cc(Br)ccc1N1C(=O)[C@H]2CCCC[C@@H]2C1=O,C20521026_decoy,WEE1,Decoy,0.0,-6.77403,-7.77,-1.57,-5.053032514692745
O=C(Nc1ccc2[nH]ncc2c1)c1ccc(Br)cc1,C20478470_decoy,WEE1,Decoy,0.0,-7.03466,-7.86,-1.76,-6.481758605925001
Cc1cc(N)c(S(=O)(=O)N2CCC(C)(C)CC2)cc1C,C61818972_decoy,WEE1,Decoy,0.0,-7.45484,-8.8,-1.69,-10.136590667875826
Cc1ccc(-c2nsc(C(=O)N3CCCCCC3)c2N)cc1,C62007073_decoy,WEE1,Decoy,0.0,-6.32684,-6.37,-0.72,-4.747710276926708
Nc1ccc(I)cc1-c1nnc2n1CCCCC2,C62824278_decoy,WEE1,Decoy,0.0,-7.55961,-8.68,-2.03,-6.550691718398821
Cc1cc(Oc2ncnc3sc(C)c(C)c23)c(C)cc1N,C62998006_decoy,WEE1,Decoy,0.0,-9.22311,-8.85,-0.2,-13.5347126675005
Cc1cc2ncn(-c3nc4ccc(N)cc4s3)c2cc1C,C63104772_decoy,WEE1,Decoy,0.0,-8.51996,-9.08,0.29,-13.020549018669335
O=C(/N=c1/[nH]c2ccccc2s1)[C@@H]1Cc2ccccc2CN1,C08974444_decoy,WEE1,Decoy,0.0,-7.11275,-7.46,-0.05,-5.5613052705972255
O=c1cc(-c2ccc(F)cc2)[nH]n1[C@@H]1Nc2ccccc2S1,C39030345_decoy,WEE1,Decoy,0.0,-7.67488,-8.2,0.29,-12.312692785363206
C[C@@]1(C2CC2)NC(=O)N(c2ccc(Br)cc2)N1,C15867893_decoy,WEE1,Decoy,0.0,-7.18964,-5.47,-0.9,-4.0614042776576
c1ccc2c(c1)CC[C@@H]2Nc1ncnc2sc3c(c12)CCNC3,C65371131_decoy,WEE1,Decoy,0.0,-9.23319,-8.86,-0.95,-7.867489892017282
Cc1ccc2cccc(NC(=O)c3ccc4cc[nH]c4c3)c2n1,C66462210_decoy,WEE1,Decoy,0.0,-7.93564,-9.93,-0.01,-8.072080173652457
Cc1cc(C)c2c(c1)N(C(=O)c1ccc(C(N)=O)cc1)CCC2,C66733055_decoy,WEE1,Decoy,0.0,-7.12651,-5.75,-0.53,-4.412249588533
N#CC1=C(N)OC(c2ccc(Br)cc2)=C(C#N)[C@@H]1c1ccccc1,C00704321_decoy,WEE1,Decoy,0.0,-7.39035,-4.85,-1.01,-4.032702316546969
Cc1cc(C)c2c3c(sc2n1)[C@H](c1ccc(F)cc1)C(C#N)=C(N)O3,C00659929_decoy,WEE1,Decoy,0.0,-7.61246,-8.17,-0.12,-5.9150805490922505
CC(=O)Nc1ccc2c(c1)[C@@H]1[C@@H]3CC[C@@H](C3)[C@@H]1[C@H](c1ccc(C#N)cc1)N2,C04623712_decoy,WEE1,Decoy,0.0,-7.8567,-5.16,-1.28,-4.376754488214544
NC1=NC(=O)/C(=C\c2ccc(-c3ccc(Br)cc3)o2)S1,C05649579_decoy,WEE1,Decoy,0.0,-8.31521,-9.03,0.59,-14.396138864626243
Cc1c(S(=O)(=O)c2ccccc2)c(N)n(C2CCCCC2)c1C,C04038051_decoy,WEE1,Decoy,0.0,-7.0082,-9.47,-1.38,-10.227711383210968
Cc1ccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)cc1,C03217491_decoy,WEE1,Decoy,0.0,-7.83455,-5.52,-0.77,-4.620062335999383
Cc1ccc(NC(=O)c2oc3c(c2C)[C@@H](O)CC(C)(C)C3)c(Br)c1,C09576567_decoy,WEE1,Decoy,0.0,-7.74774,-10.05,-0.09,-7.605691372584304
Cc1cc(C)c2c3c(sc2n1)C1(CCC(C)CC1)C(C#N)=C(N)O3,C04869591_decoy,WEE1,Decoy,0.0,-8.17911,-4.91,-0.75,-3.303652891327242
C[C@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1cc(Br)ccc1O,C15223892_decoy,WEE1,Decoy,0.0,-8.16418,-8.18,-1.54,-7.520727204171954
O=C1C[C@@H](c2ccccc2)CC2=C1[C@@H](c1ccco1)Nc1ccccc1N2,C18107048_decoy,WEE1,Decoy,0.0,-7.54857,-5.63,-1.1,-4.344146134753276
Cc1cc(NC(=O)[C@H]2CNc3ccccc3O2)ccc1Br,C19514806_decoy,WEE1,Decoy,0.0,-7.90538,-8.7,-0.49,-7.901896132903763
Cc1cc(C)c([C@@H]2[C@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)c(C)c1,C00143633_decoy,WEE1,Decoy,0.0,-6.98318,-4.53,-1.63,-3.551294250047833
CC[C@H]1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccs3)[C@@H]2C1,C13479774_decoy,WEE1,Decoy,0.0,-5.91121,-4.8,0.25,-3.012061124304944
N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc(Br)c2)[C@H]2CCCC=C12,C20058100_decoy,WEE1,Decoy,0.0,-7.60403,-4.53,-0.51,-3.379798037475005
O=C(Nc1ccc(Br)cc1)Nc1nc(C2CC2)cs1,C20542371_decoy,WEE1,Decoy,0.0,-7.98694,-7.67,-0.84,-7.0747831422994
CC(C)c1cccc(NC(=O)c2ccc3c(c2)NC(=O)CCS3)c1,C22068045_decoy,WEE1,Decoy,0.0,-8.54017,-6.17,-3.14,-5.629853901042663
O=C(c1cccc(Br)c1)N1N[C@H]2CCCC[C@H]2[C@@]1(O)C(F)(F)F,C27488966_decoy,WEE1,Decoy,0.0,-7.05517,-4.89,-0.23,-4.792904649728512
N#CC1=C(NC(=O)Nc2ccc(Cl)cc2)S[C@@H]2CCCC[C@H]12,C28579274_decoy,WEE1,Decoy,0.0,-8.54345,-9.28,-2.57,-7.630159995299808
Cn1nc(-c2ccc(Br)o2)c(-c2ccc(F)cc2)c1N,C37351700_decoy,WEE1,Decoy,0.0,-7.26377,-8.23,-0.44,-8.823535880515214
O=C(Nc1ccccc1N1CCCCC1)c1cc(Br)c[nH]1,C37494880_decoy,WEE1,Decoy,0.0,-7.90587,-7.86,0.12,-16.98335959438452
Nc1ccc(F)c(-c2nc(Cc3cccc(Br)c3)no2)c1,C37606219_decoy,WEE1,Decoy,0.0,-7.91805,-9.49,-0.56,-13.461723065020236
CON1C[C@H](c2ccccc2O)C[C@@]12CC[C@H](c1ccccc1O)C2,C39503894_decoy,WEE1,Decoy,0.0,-8.29266,-5.99,-2.17,-4.292442434380039
Oc1c(Cl)c(Cl)c2c(c1Cl)C[C@H](Nc1nccs1)O2,C39930424_decoy,WEE1,Decoy,0.0,-9.71816,-6.75,-0.32,-7.070502187970328
CC1(C)[C@@H]2[C@H]1C[C@](C)(O)C[C@H]2OC(=O)Nc1cccc2ccccc12,C39932647_decoy,WEE1,Decoy,0.0,-7.88643,-5.0,-1.62,-4.0419288776168285
Cc1ccc([C@H](C)NC(=O)Nc2ccc(Br)cc2F)o1,C40097441_decoy,WEE1,Decoy,0.0,-7.47304,-7.01,-3.31,-5.93927024516393
O=S(=O)(Nc1ccc2[nH]ccc2c1)c1ccc(Br)cc1,C40438788_decoy,WEE1,Decoy,0.0,-7.13791,-8.84,-2.5,-7.444460229341232
Nc1c(I)cnn1C1c2ccccc2Oc2ccccc21,C43667114_decoy,WEE1,Decoy,0.0,-7.75968,-5.12,-0.66,-3.259022222111127
Cc1ccc(CSc2nc3sc4c(c3c(=O)n2N)CCCC4)cc1,C36646173_decoy,WEE1,Decoy,0.0,-9.9947,-9.75,-1.05,-8.961313084366342
Nc1cccc(Cl)c1S(=O)(=O)N1CCC[C@H]2CCCC[C@@H]21,C45166286_decoy,WEE1,Decoy,0.0,-7.46497,-5.12,-4.0,-3.80623654602847
Nc1cccc(Cl)c1S(=O)(=O)N1CCC[C@@H]1C1CCCC1,C45166805_decoy,WEE1,Decoy,0.0,-7.93747,-8.38,-1.87,-9.497890273412828
COc1ccc(Br)cc1NC(=O)N[C@H]1CCCC[C@H]1C,C48861924_decoy,WEE1,Decoy,0.0,-8.05619,-7.52,-0.62,-7.922742845371747
Cc1ccc(NC(=O)c2[nH]nc(C3CC3)c2Br)cc1C,C49167792_decoy,WEE1,Decoy,0.0,-8.20716,-7.95,-0.42,-7.591139848713184
Cc1c[nH]/c(=N/C(=O)N[C@H](C)c2ccccc2Br)s1,C49201679_decoy,WEE1,Decoy,0.0,-7.66393,-5.73,-1.42,-4.9371678914771575
Cc1cc([C@H](C)NC(=O)Nc2cccc(Br)c2)c(C)o1,C49413776_decoy,WEE1,Decoy,0.0,-6.6202,-7.6,-1.68,-9.643742111922238
CCC(C)(C)[C@H]1CCc2c(sc3c2C(O)=N[C@H](c2ccco2)N3)C1,C04553415_decoy,WEE1,Decoy,0.0,-9.97433,-4.68,-0.29,-5.4186521376771175
Cc1ccc(-c2noc(-c3cc(Br)ccc3N)n2)cc1,C50208585_decoy,WEE1,Decoy,0.0,-7.69357,-9.2,-0.18,-11.71542751578583
Cc1ccc([C@@H]2CC(=O)C[C@@H](c3ccc(C)cc3)C2(C#N)C(N)=O)cc1,C51330058_decoy,WEE1,Decoy,0.0,-6.95922,-5.54,-3.33,-3.890888675371386
Cc1ccsc1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2,C57381976_decoy,WEE1,Decoy,0.0,-10.4695,-7.24,-1.55,-7.923105758163555
C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2c(N)cc(Cl)cc2Cl)C1,C37053445_decoy,WEE1,Decoy,0.0,-6.86901,-7.9,-2.78,-7.059997508034132
N#CC1=C(N)N(c2ccccc2)C2=C(C(=O)CCC2)[C@@H]1c1ccc(Cl)cc1,C59102288_decoy,WEE1,Decoy,0.0,-7.29123,-4.9,-2.24,-4.249362623564211
CC1=CC(C)(C)NC(=S)N1NC(=O)c1ccc(C(C)(C)C)cc1,C59452504_decoy,WEE1,Decoy,0.0,-7.18641,-6.78,-0.38,-6.596133989247946
NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(Cl)sc1Cl,C60241778_decoy,WEE1,Decoy,0.0,-8.38976,-4.28,-0.29,-4.775344523140436
Cc1c(N)cccc1-c1nc(-c2ccc(Br)cc2)no1,C61857302_decoy,WEE1,Decoy,0.0,-7.64449,-9.4,-0.31,-6.894819436704156
S=C(C=C1NCCc2cc3c(cc21)OCO3)NC1CCCCC1,C05353953_decoy,WEE1,Decoy,0.0,-8.00093,-8.16,-1.14,-7.330128575161234
O=C(Nc1ccc2c(c1)C1(CCCC1)C(=O)N2)c1ccc(Br)cc1,C62027314_decoy,WEE1,Decoy,0.0,-8.12364,-11.01,0.44,-21.16419575830712
C[C@@H]1CCC[C@H](c2noc(-c3cc(I)ccc3N)n2)C1,C62824347_decoy,WEE1,Decoy,0.0,-8.19595,-8.36,-0.55,-6.816112310950294
CC1CCC(c2noc(-c3cc(I)ccc3N)n2)CC1,C62824351_decoy,WEE1,Decoy,0.0,-7.95948,-5.25,-2.57,-3.321781467207777
CC(C)(C)[C@@H]1CCc2c(sc3c2C(O)=N[C@H](c2ccco2)N3)C1,C04153187_decoy,WEE1,Decoy,0.0,-7.66511,-6.3,-0.34,-4.050705482734787
Nc1ccc(-c2nc(-c3cccc(Br)c3)no2)cc1F,C63010001_decoy,WEE1,Decoy,0.0,-7.8232,-8.9,-0.95,-7.122932887017238
Nc1ccc(-c2nc(-c3ccc(Br)cc3)no2)cc1F,C63010006_decoy,WEE1,Decoy,0.0,-7.48013,-9.05,-0.94,-6.518677122150897
CC(=O)[C@@]1(O)[C@H](C)C[C@@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C,C04026099_decoy,WEE1,Decoy,0.0,-8.8821,-5.23,-2.01,-3.70464565978938
C[C@]12CC[C@H]3[C@H](CC[C@H]4C[C@@H](O)CC[C@@]43C)[C@H]1CC[C@H]2NC(=O)CCl,C04028997_decoy,WEE1,Decoy,0.0,-7.86872,-4.99,-4.57,-3.687228642547178
COC(=O)c1sc(-c2ccc(Br)cc2)cc1N,C02528649_decoy,WEE1,Decoy,0.0,-7.37467,-8.17,0.43,-15.299075020623787
O=C(Nc1ccc(Cl)cc1)Nc1cc(Cl)sc1Cl,C00141735_decoy,WEE1,Decoy,0.0,-8.25366,-6.9,-1.34,-10.875601514076571
N#CC1=C(N)Oc2c(ccc3ccccc23)[C@@H]1c1ccccc1F,C03073376_decoy,WEE1,Decoy,0.0,-7.27614,-4.41,-0.04,-3.659281566259824
O=C(Nc1ccc(Br)cc1F)NC1CCCCC1,C00461491_decoy,WEE1,Decoy,0.0,-7.18469,-8.56,-3.02,-5.662699321803754
CC(=O)[C@]1(O)[C@@H](C)C[C@H]2[C@@H]3CC=C4C[C@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C,C05020069_decoy,WEE1,Decoy,0.0,-7.26539,-5.64,-3.76,-2.723319601100918
Nc1cc(-c2ccc(Br)cc2)nn1-c1ccc(F)cc1,C01390560_decoy,WEE1,Decoy,0.0,-7.10256,-9.21,0.49,-7.305146293070258
CSc1ccc([C@@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)cc1,C00584773_decoy,WEE1,Decoy,0.0,-8.72693,-7.26,-0.23,-10.569632775050444
Cc1cc(-c2csc(N)n2)c(C)n1-c1ccc(Br)cc1,C07763029_decoy,WEE1,Decoy,0.0,-7.70908,-8.65,-0.45,-7.201096045650568
Cc1c(C)c2c(c(C)c1N)C[C@](C)(CSc1ccncc1)O2,C13652082_decoy,WEE1,Decoy,0.0,-7.49604,-8.19,-1.69,-7.187148171008029
CC(=O)Nc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1c(C)cc(C)cc1C)N2,C14457568_decoy,WEE1,Decoy,0.0,-7.43169,-8.08,-1.66,-6.137756340742111
CCC(=O)Nc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2,C14551643_decoy,WEE1,Decoy,0.0,-6.27605,-4.43,0.1,-3.23717577554314
CC(C)c1ccc(CN2CC(C)(C)Oc3ccc(N)cc32)cc1,C19759608_decoy,WEE1,Decoy,0.0,-8.56266,-7.22,-1.74,-6.723430057134217
Cc1sc2ncnc(N)c2c1-c1ccc(Br)cc1,C20321023_decoy,WEE1,Decoy,0.0,-8.18899,-7.05,-0.22,-6.621124003461152
CC1(C)CC(=O)C2=C(C1)SC(N)=C(C#N)[C@H]2c1ccc(C(F)(F)F)cc1,C01073600_decoy,WEE1,Decoy,0.0,-5.96921,-8.1,-0.72,-4.043224397725043
Cc1cc2[nH]c3c(c2cc1C)C[C@H](NC(=O)C1CCCC1)CC3,C22329038_decoy,WEE1,Decoy,0.0,-8.02872,-5.59,-2.43,-3.954177241002227
O=C(N[C@@H]1CCc2[nH]c3cc(Cl)cc(Cl)c3c2C1)[C@@H]1CC=CCC1,C22348642_decoy,WEE1,Decoy,0.0,-8.8147,-4.83,-0.6,-5.568567886174924
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(Br)cc2)CC(C)(C)C1,C30835595_decoy,WEE1,Decoy,0.0,-6.92092,-4.2,-1.93,-3.806595558793525
Nc1ccc(Oc2ccccc2I)nc1,C35453989_decoy,WEE1,Decoy,0.0,-6.55306,-7.58,-0.4,-5.836344409501302
O=C(N[C@]12CCC[C@@H]1[C@H]1CC[C@@H]2C1)N[C@@]12CCC[C@@H]1[C@H]1CC[C@@H]2C1,C05638902_decoy,WEE1,Decoy,0.0,-7.86675,-6.65,-1.79,-9.491397553580477
Nc1nc2cc(F)ccc2n1-c1ccccc1I,C36899399_decoy,WEE1,Decoy,0.0,-7.24275,-7.97,-0.02,-11.58758132996396
Nc1nc2cc(Br)ccc2n1-c1ccc(F)c(F)c1F,C36899622_decoy,WEE1,Decoy,0.0,-6.87814,-8.33,0.5,-10.671665581403168
Cc1ccc2cccc(Oc3ccc(Br)cc3N)c2n1,C36970242_decoy,WEE1,Decoy,0.0,-8.23576,-8.65,-1.32,-9.145315504494436
Cc1ccc(-c2noc(N)c2-c2ccc(Br)cc2)cc1F,C37350137_decoy,WEE1,Decoy,0.0,-7.4913,-8.24,0.08,-7.237996717372032
O[C@H]1COC[C@H]1Nc1c(Cl)cc(Br)cc1Cl,C37885383_decoy,WEE1,Decoy,0.0,-6.85545,-4.51,-0.66,-3.582951107884801
C[C@@H](Nc1cccc2cn[nH]c12)c1ccc(Br)s1,C38003026_decoy,WEE1,Decoy,0.0,-9.00849,-7.55,-0.48,-7.562278073154464
C[C@H]1CCc2nc3sc(C(=O)c4ccc(F)cc4)c(N)c3cc2C1,C39326670_decoy,WEE1,Decoy,0.0,-7.86722,-10.18,-0.06,-7.417988116667629
N#CC1=C(N)Oc2ccc3ccccc3c2[C@@H]1c1ccc(Cl)s1,C39327242_decoy,WEE1,Decoy,0.0,-9.32781,-9.39,0.41,-8.002804123625964
Brc1ccc2c(c1)CC[C@@H]2Nc1cccc2cn[nH]c12,C40227240_decoy,WEE1,Decoy,0.0,-7.13785,-8.55,-0.53,-7.152395513392467
Cc1ccc(C(N)=S)c(Oc2cc(Cl)cc(Cl)c2)n1,C43398798_decoy,WEE1,Decoy,0.0,-7.73707,-4.48,-0.03,-4.397973840931527
CCc1ccc(-c2nn(C)c(N)c2-c2ccc(Cl)cc2)s1,C43640132_decoy,WEE1,Decoy,0.0,-8.35675,-4.48,-1.95,-4.254508471611347
CCc1ccc(Cn2ncc(I)c2N)cc1,C43666561_decoy,WEE1,Decoy,0.0,-7.123,-8.31,-1.38,-7.101824423703091
CC(C)[C@@H]1CC[C@H](C)C[C@H]1n1ncc(I)c1N,C43666597_decoy,WEE1,Decoy,0.0,-7.24296,-7.25,-1.15,-7.203601630237779
Cc1cc(Br)cc(C)c1NC(=O)N[C@@H]1CCCC[C@H]1C,C48488365_decoy,WEE1,Decoy,0.0,-7.68713,-4.86,-1.63,-4.104765805398836
Cc1ccc([C@H](C)n2c(N)nc3cc(Br)ccc32)s1,C49185047_decoy,WEE1,Decoy,0.0,-7.79933,-3.97,-1.16,-4.075412822720555
C[C@H]1CCC[C@@H](NC(=O)Nc2ccc(F)cc2Br)C1,C49263305_decoy,WEE1,Decoy,0.0,-7.75501,-8.46,-2.66,-6.09735780865595
C[C@@H](C1CCCCC1)n1ncc(I)c1N,C49853174_decoy,WEE1,Decoy,0.0,-7.38033,-5.85,-3.34,-5.672605638980356
Cc1nn([C@@H]2CCCC[C@@H]2C(C)(C)C)c(N)c1I,C49853205_decoy,WEE1,Decoy,0.0,-7.94522,-7.31,-1.11,-9.110017665499132
CC[C@H]1CCc2c(sc3c2C(O)=N[C@H](c2ccc(F)cc2)N3)C1,C04545463_decoy,WEE1,Decoy,0.0,-7.31787,-5.17,-0.62,-4.001713975811729
COc1ccc([C@H]2NC(=S)N[C@H]3C(=C4SCCS4)CCC[C@@H]23)cc1,C51329889_decoy,WEE1,Decoy,0.0,-8.77291,-4.42,-1.91,-3.449105608397916
Nc1nc2ccc(F)c(F)c2n1-c1ccc(Br)cc1,C53169794_decoy,WEE1,Decoy,0.0,-7.43232,-8.5,0.44,-7.515585706221223
C[C@H]1[C@H](n2c(N)nc3cc(Br)ccc32)CCC[C@@H]1C,C36899244_decoy,WEE1,Decoy,0.0,-8.4034,-8.16,-2.7,-8.489581531717553
O=C1Nc2ccc(Br)cc2[C@H]1Nc1ccc(F)c(F)c1F,C21045928_decoy,WEE1,Decoy,0.0,,,,
O=C1Nc2ccc(Br)cc2[C@@H]1Nc1ccc(F)c(F)c1F,C21045928_decoy,WEE1,Decoy,0.0,,,,
Cc1nn([C@H](C)c2ccc(C(C)C)cc2)c(N)c1Br,C43668535_decoy,WEE1,Decoy,0.0,-7.85558,-8.47,-3.21,-7.006033112826959
Cc1nn([C@@H](c2cccs2)C(C)C)c(N)c1Br,C43668769_decoy,WEE1,Decoy,0.0,-8.27877,-6.14,-2.04,-7.600105038874253
Nc1cc(C(=O)N2CC[C@H]3CCCC[C@H]3C2)c(Br)cc1F,C61079799_decoy,WEE1,Decoy,0.0,-6.82848,-4.55,-0.6,-4.083517000801999
Nc1nc2cc(Br)ccc2n1[C@@H]1CCCc2sccc21,C61365022_decoy,WEE1,Decoy,0.0,-8.88471,-9.24,-0.55,-10.284456466970608
N[C@@H](c1ccc2nccnc2c1)c1ccc(Br)s1,C61414646_decoy,WEE1,Decoy,0.0,-8.57245,-8.43,-0.88,-12.84713370322029
Nc1c(C(=O)Nc2ccc(Cl)cn2)sc2nc3c(cc12)CCCCCC3,C00691652_decoy,WEE1,Decoy,0.0,-9.05857,-7.5,-0.37,-7.301481718232229
Cc1cccc(-n2c(N)c(C(=O)N[C@@H](C)c3ccccc3)c3nc4ccccc4nc32)c1,C02347377_decoy,WEE1,Decoy,0.0,-8.3093,-9.82,-1.0,-8.800342788171632
Cc1ccc(NC(=O)NC2(C(=O)Nc3cccc(C)c3C)CCCCC2)cc1,C04965405_decoy,WEE1,Decoy,0.0,-7.42331,-9.63,-2.76,-8.781699343398197
O=C(N/N=C/c1c[nH]c2ccccc12)c1cc(C23CC4CC(CC(C4)C2)C3)n[nH]1,C05033447_decoy,WEE1,Decoy,0.0,-8.67944,-9.24,-1.52,-7.672444009232013
O=C(NNC(=O)c1ccccc1O)c1ccc(-c2nc3ccccc3s2)s1,C07785034_decoy,WEE1,Decoy,0.0,-8.74303,-8.71,-0.53,-7.87888434563405
Nc1c(C(=O)Nc2ccccc2OC(F)(F)F)sc2nc3c(cc12)CCCCC3,C00663242_decoy,WEE1,Decoy,0.0,-9.02685,-6.05,-1.63,-6.704797821629086
Cc1ccc(NC(=O)Nc2nc(C(=O)Nc3cc(C)cc(C)c3)cs2)cc1,C09317999_decoy,WEE1,Decoy,0.0,-7.33699,-9.03,-2.34,-6.669553591924783
Cc1cccc(NC(=O)Nc2nc(C(=O)N[C@H]3C[C@@H](C)CC(C)(C)C3)cs2)c1,C09318450_decoy,WEE1,Decoy,0.0,-7.92411,-9.92,-1.98,-7.443103454338357
O=C(Nc1ccc(Cl)cc1)Nc1nc(C(=O)NC2CCCCCC2)cs1,C09319047_decoy,WEE1,Decoy,0.0,-7.77418,-8.97,-1.17,-10.75185901676236
O=C(Nc1ccc(Cl)cc1)Nc1nc(C(=O)Nc2ccc(Cl)cc2)cs1,C09319148_decoy,WEE1,Decoy,0.0,-9.37768,-8.47,-0.72,-12.40641987142017
C[C@H]1CCc2c(sc(NC(=O)c3sc4cc(Cl)ccc4c3Cl)c2C(N)=O)C1,C02417941_decoy,WEE1,Decoy,0.0,-9.81955,-10.36,-3.5,-8.9163888173987
CC(C)CC(=O)Nc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14467932_decoy,WEE1,Decoy,0.0,-8.82116,-7.37,-1.37,-8.317915378515616
CC[C@@H](C)NC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14467991_decoy,WEE1,Decoy,0.0,-9.02738,-4.83,-1.44,-5.321899769868736
C[C@@H](NC(=O)c1cccc2c1N[C@@H](c1c[nH]c3ccccc13)[C@H]1CC=C[C@H]21)c1ccccc1,C14544902_decoy,WEE1,Decoy,0.0,-8.66761,-7.55,-0.65,-7.605313817109188
Cc1cccc(C(=O)Nc2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@H](c2c[nH]c4ccccc24)N3)c1,C14553659_decoy,WEE1,Decoy,0.0,-7.63121,-10.04,-2.08,-6.700743497214201
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3ccc(Br)cc3)c2C(N)=O)C1,C01218278_decoy,WEE1,Decoy,0.0,-9.85314,-8.42,-1.15,-7.815608045049789
CC(=O)O[C@H]1CC[C@]2(C)C(=CC[C@@H]3[C@H]2CC[C@]2(C)[C@@H](/C(C)=N/NC(N)=O)CC[C@@H]32)C1,C16925720_decoy,WEE1,Decoy,0.0,-7.87142,-5.49,-2.61,-5.0657777309084
Cc1cc(COc2ccc(Cl)cc2C)c(C)c([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)c1,C17099298_decoy,WEE1,Decoy,0.0,-7.92367,-8.47,-1.58,-6.885741398975901
CC(/C=C/c1ccccc1)=N\NC(=O)c1cc(Br)cc(Br)c1N,C19800814_decoy,WEE1,Decoy,0.0,-8.63337,-5.73,-1.49,-5.774524624663504
CC1=C(C(=O)Nc2ccc(F)c(F)c2)[C@H](c2ccc(C(C)C)cc2)NC(=S)N1,C08769247_decoy,WEE1,Decoy,0.0,-8.77695,-5.25,-1.72,-5.705756265719326
C[C@@H](NC(=O)c1cccc2c1N[C@H](c1c[nH]c3ccccc13)[C@H]1CC=C[C@@H]21)c1ccccc1,C20720297_decoy,WEE1,Decoy,0.0,-8.38389,-10.52,-1.87,-9.152713296169315
Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccc(-c3ccc(F)cc3)o2)c1Cl,C20885304_decoy,WEE1,Decoy,0.0,-9.36232,-9.48,-0.34,-8.597762322160131
CN(C)c1ccc([C@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@@H]3c2ccccc2O)cc1,C21225245_decoy,WEE1,Decoy,0.0,-6.82864,-5.37,-3.42,-4.722340933859087
CN(C)c1ccc([C@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@H]3c2ccccc2O)cc1,C21225253_decoy,WEE1,Decoy,0.0,-8.98751,-5.78,-2.01,-5.66606929813432
C[C@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(=O)Nc1ccc(Cl)cn1,C21226020_decoy,WEE1,Decoy,0.0,-10.5789,-9.63,-5.32,-8.855677123226954
O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2cc(Br)ccc2F)cc1,C23011588_decoy,WEE1,Decoy,0.0,-7.19677,-9.43,-1.34,-7.391676568945245
C=CC(C)(C)c1cc([C@@H]2COc3c(cc4c(c3O)OC(C)(C)C=C4)C2)c(O)c(O)c1OC,C31170064_decoy,WEE1,Decoy,0.0,-10.5314,-5.08,-1.09,-5.693911326709888
Cc1ccc(C)c(Nc2nc(N)c(C(=O)c3ccc(Br)cc3)s2)c1,C32947525_decoy,WEE1,Decoy,0.0,-9.48931,-4.76,-0.11,-6.643823308669406
CCC(=O)Nc1nc2c(C)cc(NC(=O)Nc3cc(C)cc(C)c3)cc2s1,C33008275_decoy,WEE1,Decoy,0.0,-7.42474,-7.53,-3.03,-6.284573508035037
O=C(Nc1ccccc1)Nc1ccc2sc(NC(=O)C3CCCCC3)nc2c1,C33129533_decoy,WEE1,Decoy,0.0,-7.79532,-9.4,-0.97,-7.358155633628393
Cc1ccc2nc(-c3ccc(N/C(N)=N\c4nc(C)cc(C)n4)cc3)sc2c1,C05900749_decoy,WEE1,Decoy,0.0,-9.21716,-9.58,-2.43,-7.640170768421982
CC(C)Nc1nc(-c2ccc(F)cc2)c2c(N)n(-c3ccc(Cl)cc3)nc2n1,C35576981_decoy,WEE1,Decoy,0.0,-8.00349,-5.8,-2.3,-5.032368642148922
Nc1c2c(-c3ccccc3F)nc(NC3CCCC3)nc2nn1-c1cccc(F)c1,C35577776_decoy,WEE1,Decoy,0.0,-7.77574,-6.04,-3.9,-4.4142825824250815
CC[C@H]1CCc2c(sc(NC(=O)C3c4ccccc4Oc4ccccc43)c2C(N)=O)C1,C00694529_decoy,WEE1,Decoy,0.0,-10.1953,-5.62,-1.38,-5.481213990203658
Oc1ccccc1[C@@H]1CC[C@@]2(C1)C[C@H](c1ccccc1O)CN2c1ccccc1O,C39503378_decoy,WEE1,Decoy,0.0,-9.45526,-5.31,-1.99,-5.299057134833512
COc1ccc(C)cc1Nc1ncnc(N2C[C@@]3(C)C[C@@H]2CC(C)(C)C3)c1N,C40684222_decoy,WEE1,Decoy,0.0,-6.96374,-6.26,-0.82,-4.865334656502701
Nc1c(Nc2ccc(Cl)cc2Cl)ncnc1Sc1ccc(Cl)cc1,C40723049_decoy,WEE1,Decoy,0.0,-8.32295,-7.87,-0.75,-6.905424100419387
Cc1ccc2nc(Nc3ncnc(Sc4ccc(Cl)cc4)c3N)sc2c1,C40723052_decoy,WEE1,Decoy,0.0,-10.673,-8.78,-0.57,-7.875980546037311
CC1(C)C[C@H]2C[C@](C)(CN2c2ncnc(Nc3ccc(Cl)cc3Cl)c2N)C1,C40735023_decoy,WEE1,Decoy,0.0,-7.35913,-5.98,-1.76,-4.302655179879427
Nc1c(Nc2ccc(Br)cc2F)ncnc1Oc1cccc2cccnc12,C40752195_decoy,WEE1,Decoy,0.0,-7.35705,-6.28,-1.18,-4.621945289924852
Nc1c(NC23CC4CC(CC(C4)C2)C3)ncnc1N1CCN(c2ccccc2F)CC1,C40755833_decoy,WEE1,Decoy,0.0,-8.97769,-8.48,-3.17,-7.415933100475586
Cc1cc(C)cc(NC(=O)NCC2CCN(C(=O)Nc3ccc(F)cc3)CC2)c1,C44006032_decoy,WEE1,Decoy,0.0,-7.96145,-9.64,-3.17,-8.869054293003384
Nc1c2c(-c3ccccc3F)nc(NC3CCCCC3)nc2nn1-c1cccc(F)c1,C44854616_decoy,WEE1,Decoy,0.0,-9.29219,-10.28,-4.22,-7.96245524040411
Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1nc(N)c2c(C)c(C)sc2n1,C46581460_decoy,WEE1,Decoy,0.0,-9.47469,-9.21,-1.61,-8.999942649877468
CCC(C)(C)[C@@H]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(C)ccc2O)N3)C1,C04545704_decoy,WEE1,Decoy,0.0,-9.27723,-9.2,-0.87,-7.883407572167213
CCC(C)(C)[C@H]1CCc2c(sc3c2C(O)=N[C@@H](c2cccc(C)c2O)N3)C1,C04553445_decoy,WEE1,Decoy,0.0,-7.93644,-7.52,-0.79,-6.148126285019404
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N=c1[nH]c2ccccc2[nH]1,C17304046_decoy,WEE1,Decoy,0.0,-8.21077,-8.66,-4.31,-8.869958762649624
COc1cc(N)c2nc(Nc3nc4cc(-c5ccccc5)ccc4o3)sc2c1,C57352567_decoy,WEE1,Decoy,0.0,-8.37485,-10.87,-0.47,-13.222335945351093
Nc1nc2n(n1)[C@@H](c1cccc(Br)c1)C[C@H](c1ccc(Cl)cc1Cl)N2,C13880442_decoy,WEE1,Decoy,0.0,-10.3147,-7.72,-1.41,-7.37191703627923
CC(C)C1=C(C(=O)Nc2ccc3nc(-c4cc(F)ccc4F)[nH]c3c2)[C@@H](C)NO1,C64109231_decoy,WEE1,Decoy,0.0,-8.24218,-10.21,-1.82,-14.752466020457058
Cc1ccc(N(C(=O)NC(=O)NS(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1,C04428097_decoy,WEE1,Decoy,0.0,-8.32956,-6.15,-3.73,-6.585810746211558
Cc1ccc(C)c(S(=O)(=O)c2c(N)n(/N=C/c3ccc(N(C)C)cc3)c3nc4ccccc4nc23)c1,C02198504_decoy,WEE1,Decoy,0.0,-8.84565,-10.17,-3.58,-7.77089897020651
Cc1ccc(S(=O)(=O)c2c(N)n(CCOC(=O)c3ccc(F)cc3)c3nc4ccccc4nc23)cc1,C02418952_decoy,WEE1,Decoy,0.0,-8.07752,-9.71,-3.29,-7.626788985449645
COc1cc(OC)c(NS(=O)(=O)c2cc(C(=O)NC3CCCC3)c(Cl)cc2Cl)cc1Cl,C03341234_decoy,WEE1,Decoy,0.0,-9.90904,-7.13,-4.76,-8.527433389557755
C=CCN(C)C(=O)[C@@H](C)[C@H]1CC[C@@]2(C)Cc3sc(NS(=O)(=O)c4ccc(Cl)cc4)nc3[C@@H](C)[C@@H]2[C@H]1O,C04150003_decoy,WEE1,Decoy,0.0,-9.59125,-9.01,-2.49,-9.538453919524132
O=C(NC(=S)Nc1ccccc1-c1nc2ccccc2s1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1,C08835257_decoy,WEE1,Decoy,0.0,-8.93631,-10.13,-2.92,-8.449044840963772
Cc1ccc(NC(=O)[C@H]2[C@H]3C(=O)N(CCC(C)C)[C@H](C(=O)N[C@@H]4CCC[C@H](C)[C@@H]4C)[C@]34C=C[C@H]2O4)cc1C,C09777234_decoy,WEE1,Decoy,0.0,-9.85116,-9.29,-3.94,-8.078408230661035
Cc1c(C(=O)NNC(=O)c2csc3c2CCCC3)nnn1-c1ccc2noc(-c3ccccc3)c2c1,C12274462_decoy,WEE1,Decoy,0.0,-9.83266,-10.9,-0.58,-8.831059500163214
COc1cc([C@@H]2Nc3ccc(S(=O)(=O)Nc4ccc(C)cc4C)cc3[C@@H]3C=CC[C@H]32)cc(OC)c1OC,C13640951_decoy,WEE1,Decoy,0.0,-8.98269,-9.43,-2.51,-8.179558668168854
COc1cc([C@@H]2Nc3ccc(S(=O)(=O)Nc4cc(C)cc(C)c4)cc3[C@@H]3C=CC[C@H]32)cc(OC)c1OC,C13640959_decoy,WEE1,Decoy,0.0,-9.88355,-9.41,-3.7,-8.333471964368606
Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)Nc2nnc(-c3ccc(Br)cc3)s2)c1C,C16572409_decoy,WEE1,Decoy,0.0,-8.40762,-5.99,-1.46,-5.24668048874023
COc1ccc(-c2nnc(NC(=O)[C@H]3CCCN3C(=O)Nc3c(C(C)C)cccc3C(C)C)s2)cc1,C16572527_decoy,WEE1,Decoy,0.0,-7.99678,-8.9,-2.6,-9.693083435832031
CC[C@H](Oc1ccccc1F)C(=O)Nc1sc2c(c1C(=O)N[C@@H]1CCS(=O)(=O)C1)CC[C@H](C)C2,C16806193_decoy,WEE1,Decoy,0.0,-10.3472,-9.03,-1.85,-9.27616059054269
CCOC(=O)C1=c2s/c(=C/c3ccccc3F)c(=O)n2[C@@H](c2ccccc2F)C(C(=O)OC)=C1N,C20459042_decoy,WEE1,Decoy,0.0,-7.08849,-4.6,-1.26,-5.061826863345374
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N(C)[C@@H](C)c3cccc(NC(=O)c4ccccc4)c3)C2=O)cc1,C21625779_decoy,WEE1,Decoy,0.0,-8.54514,-10.23,-3.3,-10.358759064702577
COc1c(C)cccc1C(=O)NC(=S)Nc1ccc(N2CCN(C(=O)c3ccc(C)cc3)CC2)cc1,C22826119_decoy,WEE1,Decoy,0.0,-8.03837,-7.53,-3.08,-6.7669527571253605
C[C@@H](Sc1nnc(-c2cccs2)n1N)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1,C23472937_decoy,WEE1,Decoy,0.0,-10.8233,-7.05,-2.8,-10.634947558438906
CCc1sc2nc(SCC(=O)N3CCC[C@H](C(N)=O)C3)n(Cc3ccc(C)cc3)c(=O)c2c1C,C24141440_decoy,WEE1,Decoy,0.0,-8.35355,-8.35,-3.09,-7.197524482600284
COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1OC,C06146437_decoy,WEE1,Decoy,0.0,-9.95892,-9.56,-3.58,-9.253994661164423
COc1ccc([C@@H]2C(C(=O)c3ccc(C)cc3)=C(N)N(c3ccc([N+](=O)[O-])cc3)C3=C2C(=O)CCC3)cc1,C27528334_decoy,WEE1,Decoy,0.0,-6.83934,-5.51,-2.13,-4.835149116490732
CC[C@@H](CO)CNc1nc(SC)nc2c1sc1nc(N3CCOCC3)c3c(c12)CC(C)(C)OC3,C28286083_decoy,WEE1,Decoy,0.0,-10.5526,-8.59,-1.75,-9.153733233030556
CCn1nc(C)c(C/N=C(\NC(=O)c2ccc3c(c2)OCO3)Nc2ccc(Br)cc2)c1C,C32971813_decoy,WEE1,Decoy,0.0,-8.73259,-6.93,-2.44,-7.617622008699289
CC(C)c1ccc(NC(=O)[C@H]2[C@H]3C=C[C@]4(O3)[C@H]2C(=O)N(C(C)(C)C)[C@@H]4C(=O)N[C@H]2CCCC[C@H]2C)cc1,C33695519_decoy,WEE1,Decoy,0.0,-7.1178,-5.96,-2.63,-4.676577084742166
Cc1cc([C@H]2CC[C@H](C(=O)NCc3ccc4c(c3)OCO4)CN2C(=O)NCc2ccccc2)ccc1F,C34716503_decoy,WEE1,Decoy,0.0,-8.64368,-9.87,-3.06,-9.752000916074078
CCN1C(=O)N[C@@H](c2ccc(C(F)(F)F)cc2)C2=C1CN([C@H](C(=O)NC1CCCCC1)C(C)C)C2=O,C34791046_decoy,WEE1,Decoy,0.0,-8.44395,-5.53,-2.71,-5.426944446853281
COc1ccc(C(=O)NC2CCC(NC(=O)[C@H]3CCCN3C(=O)c3ccc(C(C)(C)C)cc3)CC2)cc1,C34903822_decoy,WEE1,Decoy,0.0,-9.431,-7.02,-4.17,-6.022369163717262
CC[C@H](C)NC(=O)CN1CN(c2ccccc2)C2(CCN(C(=O)Nc3ccc(SC)cc3)CC2)C1=O,C35744269_decoy,WEE1,Decoy,0.0,-8.30361,-5.33,-3.77,-5.135439408252742
COc1cccc(CN2Cc3cc(NC(=O)Nc4ccc(C(C)C)cc4)ccc3O[C@H](C)C2=O)c1OC,C35909988_decoy,WEE1,Decoy,0.0,-8.95477,-10.2,-4.07,-9.17844999153139
CCN(CC)C(=O)c1cc(NC(=O)c2cccs2)ccc1N1CCCN(C(=O)NC(C)(C)C)CC1,C36005913_decoy,WEE1,Decoy,0.0,-6.67966,-5.35,-3.16,-5.098405890341627
O=C(Nc1cccc([C@@H]2OC(=O)N(Cc3ccc(F)cc3)[C@@H]2C(=O)Nc2ccccc2)c1)c1ccccc1,C36218090_decoy,WEE1,Decoy,0.0,-7.0111,-9.83,-2.68,-8.048794457941435
O=C(Nc1cccc([C@@H]2OC(=O)N(Cc3ccccc3)[C@H]2C(=O)Nc2ccccc2)c1)c1ccccc1F,C36221199_decoy,WEE1,Decoy,0.0,-8.40802,-9.39,-2.04,-7.11986746058987
Cc1ccc(S(=O)(=O)CNC(=O)[C@H](c2ccccc2O)N(C(=O)C#Cc2ccccc2)C(C)(C)C)cc1,C36586109_decoy,WEE1,Decoy,0.0,-7.90269,-9.11,-3.3,-9.071550876364654
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)sc2c1CC[C@H](C)C2,C12064290_decoy,WEE1,Decoy,0.0,-10.3956,-8.73,-1.9,-8.811944556974618
COc1cc([C@@H]2C(C#N)=C(N)O[C@@H]3N=NC(C)=C23)cc(Br)c1OCc1ccc(Cl)cc1,C38611433_decoy,WEE1,Decoy,0.0,-8.31536,-5.76,-3.34,-5.151638922037085
Cc1cccc(NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)OCO3)N2CCN(c3ccccc3F)CC2)c1,C38621035_decoy,WEE1,Decoy,0.0,-8.71846,-9.75,-3.06,-9.058231289473207
Cc1cccc(NC(=O)C(=O)NC[C@H](c2ccc3c(c2)OCO3)N2CCN(c3ccccc3F)CC2)c1,C38621037_decoy,WEE1,Decoy,0.0,-9.42551,-9.57,-3.64,-8.433566620513762
COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4oc5ccc(F)cc5c4C)ccc32)c(OC)c1,C38688459_decoy,WEE1,Decoy,0.0,-9.09978,-8.02,-2.4,-6.712044081249459
COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4oc5ccc(F)cc5c4C)ccc32)cc1,C38700911_decoy,WEE1,Decoy,0.0,-9.38324,-10.1,-1.05,-8.204370047981257
COc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@H](c4ccc(OC)c(CSC5=NCCS5)c4)[C@H]32)cc1,C08437641_decoy,WEE1,Decoy,0.0,-9.28399,-5.67,-1.41,-5.061979007160361
CC1(C)[C@]2(C)CC[C@@]1(C(=O)NNC(=O)c1ccc(Cl)cc1Cl)c1nc3cc4c(cc3nc12)OCO4,C33808853_decoy,WEE1,Decoy,0.0,-9.3341,-7.17,-3.56,-6.1872112067394
O=C(Nc1cccc([C@@H]2OC(=O)N(Cc3ccccc3)[C@@H]2C(=O)Nc2ccccc2)c1)c1ccc(F)cc1,C40406375_decoy,WEE1,Decoy,0.0,-7.46387,-10.04,-3.76,-7.953828192795957
Nc1nc(CSc2nnc(-c3cccs3)n2C[C@@H]2CCCO2)nc2sc3c(c12)CCCCC3,C45599405_decoy,WEE1,Decoy,0.0,-10.5861,-9.42,-2.85,-12.457692059704112
N#Cc1c(NC(=O)C(=O)N/N=C/c2ccccc2OC(=O)c2ccc(Cl)cc2)sc2c1CCCC2,C02542440_decoy,WEE1,Decoy,0.0,-9.12435,-9.49,-1.17,-8.949446044606344
O=C(Nc1ccc2c(c1)OCO2)c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc(Cl)c(Cl)c1)N2,C00714903_decoy,WEE1,Decoy,0.0,-8.87812,-10.32,-3.16,-8.157997785792952
O=C(Nc1ccc2c(c1)OCO2)c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccc(Cl)c(Cl)c1)N2,C00714902_decoy,WEE1,Decoy,0.0,-8.34125,-7.57,-0.77,-5.727983603014185
COc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccc4c(c2)OCO4)N3)c(OC)c1,C58849328_decoy,WEE1,Decoy,0.0,-9.34989,-8.13,-3.89,-7.389401032292599
CCCc1cc(=O)[nH]c(SCC(=O)Nc2c(Br)cc([N+](=O)[O-])cc2Br)n1,C34780423_decoy,WEE1,Decoy,0.0,-8.28174,-7.16,-2.88,-7.309049094157405
CCOC(=O)C1=C(N)OC2=C(C(=O)CC(C)(C)C2)[C@]12C(=O)N1c3c(cccc32)[C@@H](C)CC12CCCCC2,C22828457_decoy,WEE1,Decoy,0.0,-6.50538,-4.95,-2.48,-2.983644300405601
O=C(CSc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2s1)Nc1ccccc1[N+](=O)[O-],C59474803_decoy,WEE1,Decoy,0.0,-9.21535,-6.3,-3.11,-5.209571631234266
O=C(CSc1nnc(-c2ccc(Br)cc2)n1-c1ccccc1)NNC(=O)c1ccccc1,C59821777_decoy,WEE1,Decoy,0.0,-9.37458,-8.76,-2.21,-9.861077755968116
CSc1nc2ccc(NC(=O)C3CCN(S(=O)(=O)c4ccccc4C(F)(F)F)CC3)cc2s1,C03373252_decoy,WEE1,Decoy,0.0,-9.96535,-9.77,-3.18,-7.756455895302632
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)cc1,C08869224_decoy,WEE1,Decoy,0.0,-10.2309,-9.61,-3.99,-12.607339211981696
O=C(Nc1nc(-c2ccccc2)c(-c2ccccc2)s1)[C@H]1CCCN1S(=O)(=O)c1ccc(F)cc1,C08895625_decoy,WEE1,Decoy,0.0,-8.52812,-9.69,-4.13,-9.280192664762504
O=C(Nc1ccc(I)cc1C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1,C08900736_decoy,WEE1,Decoy,0.0,-7.64682,-6.04,-0.75,-5.2334559519098605
O=C(Nc1sccc1-c1nc2ccccc2s1)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1,C08978262_decoy,WEE1,Decoy,0.0,-10.4233,-5.13,-2.78,-5.823626357367038
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)Nc3ccccc3-c3nc4ccccc4s3)cc2)C[C@@H](C)O1,C09404700_decoy,WEE1,Decoy,0.0,-8.1872,-9.98,-3.4,-7.779534229307542
O=C(c1cccs1)[C@@H]1[C@@H](C(=O)c2ccncc2)[C@]2(C(=O)Nc3ccccc32)[C@H]2C=Cc3ccccc3N12,C09309437_decoy,WEE1,Decoy,0.0,-8.39925,-5.12,-3.05,-5.104405533495639
Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N2CCN(c3nc4cc(C)cc(C)c4s3)CC2)cc1,C09298600_decoy,WEE1,Decoy,0.0,-9.22753,-5.38,-2.13,-4.620763048648605
Cc1cc(C)c(-c2csc(NC(=O)C3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)n2)c(C)c1,C11121905_decoy,WEE1,Decoy,0.0,-10.0714,-10.09,-2.86,-8.533588923614898
Cc1nc2ccc(NC(=O)c3cccc(S(=O)(=O)N4CCN(c5ccc(F)cc5)CC4)c3)cc2s1,C13131792_decoy,WEE1,Decoy,0.0,-10.3461,-7.8,-3.82,-9.183721418299326
Cc1c(NS(=O)(=O)c2ccccc2)cccc1C(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1,C13678423_decoy,WEE1,Decoy,0.0,-7.80243,-8.44,-2.4,-6.228440080033465
O=C(Nc1ccccc1Br)[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2)c2ccccc2O1,C13679782_decoy,WEE1,Decoy,0.0,-8.52936,-8.82,-3.49,-8.055128681061984
CC(C)c1ccc(N2/C(=N/C=C(\C#N)C(=O)Nc3ccc(Cl)cc3)S[C@@H]3CS(=O)(=O)C[C@H]32)cc1,C13686131_decoy,WEE1,Decoy,0.0,-9.58884,-8.42,-0.89,-7.304098306985472
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)Nc3nc(-c4ccc(Cl)cc4Cl)cs3)C2)cc1,C14021394_decoy,WEE1,Decoy,0.0,-9.49497,-8.82,-2.05,-8.295168870982565
Cc1cc(Br)cc(C)c1O[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1,C14642634_decoy,WEE1,Decoy,0.0,-8.07226,-7.95,-2.97,-6.674916277394965
CC(C)c1ccc([C@@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(Cc4ccc5c(c4)OCO5)CC(=O)N23)cc1,C16042321_decoy,WEE1,Decoy,0.0,-9.18913,-9.85,-4.25,-8.764160268054916
Cc1ccc(-n2c(-c3ccc(F)cc3)cc(C(=O)N3CCN(C(=O)Nc4cccc(F)c4)CC3)c2C)cc1,C16567120_decoy,WEE1,Decoy,0.0,-7.72523,-9.53,-2.51,-6.36701925464613
Cc1ccc(CNc2nc3ccc(C)cn3c(=O)c2/C=C2\SC(=S)N(Cc3ccco3)C2=O)cc1,C16734677_decoy,WEE1,Decoy,0.0,-7.64649,-6.04,-2.07,-5.122147925860857
Cc1ccc(-n2c(SCC(=O)Nc3c(F)cc(F)cc3Br)nnc2-c2ccco2)cc1,C02452980_decoy,WEE1,Decoy,0.0,-7.85098,-8.59,-1.0,-7.435746120917714
O=C(Nc1nnc([C@@H]2CC(=O)N(c3ccc(F)cc3)C2)s1)[C@H](Sc1ccccc1)c1ccccc1,C20579727_decoy,WEE1,Decoy,0.0,-10.008,-9.26,-3.15,-9.597618245664972
Cc1cc(C)cc(NC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)CCCN4C(=O)C3CCC3)CC2)c1,C21114060_decoy,WEE1,Decoy,0.0,-8.23717,-10.84,-2.13,-8.177275051944767
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)CN(c1ccc(Cl)c(C(F)(F)F)c1)S(C)(=O)=O,C22338394_decoy,WEE1,Decoy,0.0,-8.13551,-9.83,-2.86,-8.161612758579809
Cc1cc(N(CC(=O)N[C@H](C)c2ccc(N3CCCCC3)cc2)S(C)(=O)=O)ccc1Br,C22364938_decoy,WEE1,Decoy,0.0,-10.2472,-9.39,-2.9,-13.053860388451826
C/C(CC12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2)=N/NC(=O)c1cc(C2CC2)nc2c1c(C1CC1)nn2C,C22860147_decoy,WEE1,Decoy,0.0,-10.4834,-9.2,-2.11,-11.337969447425284
CC1(C)OC[C@H](CNC(=O)c2cncn2-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)O1,C23456673_decoy,WEE1,Decoy,0.0,-6.7998,-9.29,-2.81,-6.532009374777944
Cc1cc(I)ccc1NC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)O[C@@H](C)C2)cc1,C12562034_decoy,WEE1,Decoy,0.0,-8.82299,-7.97,-1.65,-6.962129637492433
Cc1ccc(Cl)cc1N1CCN(C(=O)c2ccc(NC(=O)[C@@H]3CC(=O)OC34CCCCC4)cc2)CC1,C27739356_decoy,WEE1,Decoy,0.0,-10.1544,-9.4,-4.51,-12.353225296199152
O=C(/C=C/c1ccc(-c2ccc(F)cc2)o1)Nc1ccc(N2CCN(C(=O)c3ccccc3F)CC2)cc1,C30827598_decoy,WEE1,Decoy,0.0,-9.1676,-7.35,-2.51,-5.62249831488789
Cc1ccc(NC(=O)[C@@H]2CCCN(c3ccc4cc(S(=O)(=O)N5CCCCC5)ccc4n3)C2)cc1C,C33255654_decoy,WEE1,Decoy,0.0,-10.0246,-8.75,-3.72,-12.741639353254335
CCC(=O)OCC(=O)[C@]12OC(C)(C)O[C@@H]1C[C@H]1[C@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@@H](O)C[C@@]12C,C34835397_decoy,WEE1,Decoy,0.0,-9.45493,-5.96,-3.75,-5.826749555734839
CC(C)c1ccccc1N1C(=O)CS[C@@H]1c1ccc(NS(=O)(=O)C[C@]23CC[C@H](CC2=O)C3(C)C)cc1,C35564647_decoy,WEE1,Decoy,0.0,-7.77294,-9.45,-2.28,-6.680272519269315
Cc1ccccc1C(=O)N1[C@@H](C(=O)N[C@@H](C)c2ccccc2)COC12CCN(C(=O)c1cccs1)CC2,C35987364_decoy,WEE1,Decoy,0.0,-9.22354,-5.24,-4.54,-6.243048513264626
Cc1ccc(C(=O)N2CCN(c3ccc(NC(=O)c4cccs4)cc3C(=O)N3CCCCC3)CC2)cc1,C36019356_decoy,WEE1,Decoy,0.0,-10.8407,-8.02,-2.07,-7.642175708791038
CC(C)NC(=O)c1csc(COc2ccc3c(c2)[C@@H](c2ccccc2)N(C(=O)C2CCCC2)CC3)n1,C37602346_decoy,WEE1,Decoy,0.0,-10.0678,-9.04,-4.4,-10.822840386543
O=C(NC[C@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2F)CC1)c1ccc(C(F)(F)F)cc1,C38620632_decoy,WEE1,Decoy,0.0,-8.60408,-11.05,-4.1,-8.649990921419514
Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc(C(=O)Nc4ccccc4C(F)(F)F)cc3)CC2)cc1,C38849815_decoy,WEE1,Decoy,0.0,-8.50678,-6.62,-2.12,-4.902771496401328
CCCn1c(NCc2ccc(F)cc2)c(/C=C2/SC(=S)N(C3CCCCC3)C2=O)c(C)c(C#N)c1=O,C39851698_decoy,WEE1,Decoy,0.0,-8.22836,-8.88,-3.06,-7.85190672533427
Cc1ccc(-n2c(SCC(=O)Nc3ccccc3F)nc3sc4c(c3c2=O)CCN(C(C)C)C4)cc1,C39869557_decoy,WEE1,Decoy,0.0,-9.41506,-9.37,-1.81,-8.527638830517633
CC(C)OC(=O)CN1C(=O)[C@@H]2[C@H]3C[C@H]([C@H]4Sc5[nH]c(=O)sc5[C@@H](c5ccc(F)cc5)[C@H]34)[C@@H]2C1=O,C39884037_decoy,WEE1,Decoy,0.0,-7.67009,-4.53,-2.18,-5.054701006222667
Cc1ccc(/C=C2\SC(=S)N(CC(=O)Nc3nnc(SCc4ccc(C)cc4)s3)C2=O)cc1,C39885771_decoy,WEE1,Decoy,0.0,-10.5085,-10.28,-2.23,-10.528099873710742
CC(C)Oc1ccc2c(C(=O)N3CC=C(c4c[nH]c5ccc(Br)cc45)CC3)cc(=O)oc2c1,C41551542_decoy,WEE1,Decoy,0.0,-9.22709,-9.84,-0.57,-7.988735828520418
CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@]4(F)[C@H](O)C[C@]3(C)[C@@]2(C(=O)COC(=O)C2CC2)O1,C43757664_decoy,WEE1,Decoy,0.0,-7.69248,-6.31,-2.29,-4.990916552996766
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4(C)[C@]3(Cl)[C@@H](O)C[C@@]2(C)[C@@]1(OC(=O)c1ccco1)C(=O)CCl,C44491443_decoy,WEE1,Decoy,0.0,-7.51275,-4.79,-2.79,-4.510882311938681
Cc1ccc(N2C[C@@H](C(=O)Nc3ccc4c(c3)CCCN4S(=O)(=O)c3ccccc3)CC2=O)cc1C,C49503900_decoy,WEE1,Decoy,0.0,-9.66894,-10.1,-4.14,-11.864871224483275
Cc1c(CN(C)C(=O)c2nn3c(c2Br)N[C@H](c2cccs2)C[C@@H]3C(F)(F)F)cnn1C,C00649125_decoy,WEE1,Decoy,0.0,-9.36398,-8.77,-1.69,-12.606600066253542
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(-c3ccc(F)cc3)cc(C(=O)Nc3ccc(C(C)C)cc3)c12,C57310317_decoy,WEE1,Decoy,0.0,-9.26299,-6.94,-0.24,-6.089348104323814
Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccc(Br)cc2)c2ccccc2F)cc1,C20499721_decoy,WEE1,Decoy,0.0,-8.22521,-5.43,-4.78,-5.881883789806591
[H]/N=C1C(=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)/C(=O)N=C2SC(C3CCCCC3)=NN2/1,C26641855_decoy,WEE1,Decoy,0.0,-9.9046,-8.83,-1.81,-10.285837089629872
Cc1nn(C)cc1CN(C)C(=O)c1nn2c(c1Br)N[C@H](c1cccs1)C[C@@H]2C(F)(F)F,C13124513_decoy,WEE1,Decoy,0.0,-9.87067,-8.71,-1.36,-13.771376212331884
Cc1ccc(NC(=O)C2CCN(S(=O)(=O)c3cc(C(=O)N4CCC(C)CC4)cs3)CC2)cc1C,C35424579_decoy,WEE1,Decoy,0.0,-9.77755,-9.03,-2.3,-7.391551652078425
O=C(Nc1ccc2c(c1)OCO2)C1CC[NH+]([C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)CC1,C08881015_decoy,WEE1,Decoy,0.0,-7.85832,-10.34,-5.65,-8.26292010852831
C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C#N)CC(C)(C)[NH2+]C4(C)C)cc2)C[C@H](C)O1,C08881799_decoy,WEE1,Decoy,0.0,-9.63311,-9.57,-2.02,-7.579005868549753
CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[NH+]2CCc3sccc3[C@@H]2c2cccs2)C1=O,C09155190_decoy,WEE1,Decoy,0.0,-8.71062,-8.22,-1.34,-8.532237901344558
CCOC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C09391510_decoy,WEE1,Decoy,0.0,-10.8618,-10.36,-1.4,-20.584447224232104
CC1(C)Cc2c(sc(NC(=O)[C@@H]3CCCN(S(=O)(=O)c4cccs4)C3)c2C#N)C(C)(C)[NH2+]1,C10755350_decoy,WEE1,Decoy,0.0,-11.6234,-9.36,-1.64,-11.301352804429357
CC1(C)Cc2c(sc(NC(=O)C3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)c2C#N)C(C)(C)[NH2+]1,C11123190_decoy,WEE1,Decoy,0.0,-10.2045,-9.88,-2.54,-8.228644642442854
O=C(/C=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1)Nc1ccc(N2CC[NH2+]CC2)c([N+](=O)[O-])c1,C20154393_decoy,WEE1,Decoy,0.0,-9.97387,-7.3,-1.45,-6.912556545606542
C[C@H](c1nnc(S[C@H](C)C(=O)NC(=O)NC2CCCCC2)n1-c1ccc(Cl)cc1)[NH+](C)C,C22620725_decoy,WEE1,Decoy,0.0,-9.00812,-7.62,-2.49,-7.990394250728336
C[C@@H](Sc1nnc([C@H](C)[NH+](C)C)n1-c1ccc(Cl)cc1)C(=O)NC(=O)NC1CCCCC1,C22620731_decoy,WEE1,Decoy,0.0,-9.99556,-7.9,-2.73,-7.719180634068704
CC(=O)[NH+]=c1ccc2c(COC(=O)c3ccccc3NC(=O)Cc3ccccc3)cc(O)oc-2c1,C22825107_decoy,WEE1,Decoy,0.0,-9.54198,-9.25,-1.36,-9.287309038628434
O=C(NC(=S)Nc1ccc(N2CC[NH+](Cc3ccc(Cl)cc3)CC2)cc1)c1ccc2c(c1)OCO2,C32127134_decoy,WEE1,Decoy,0.0,-10.7482,-7.75,-2.44,-8.796920246971126
O=C(NCCc1ccc(Cl)cc1Cl)[C@@H]1CSC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)[NH2+]1,C34857286_decoy,WEE1,Decoy,0.0,-9.76078,-8.65,-3.18,-7.345873689982008
Cc1cccc(N[C@@H](c2ccc3c(c2)OCO3)c2c(NC(=O)c3ccccc3)sc(C)c2C)[nH+]1,C35476906_decoy,WEE1,Decoy,0.0,-11.4566,-5.84,-2.1,-6.514782015078019
Cc1ccc(S(=O)(=O)N2CCCN(c3ccc(NC(=O)Nc4cccc(F)c4)c[nH+]3)CC2)cc1,C35842959_decoy,WEE1,Decoy,0.0,-7.64968,-10.0,-4.74,-6.300676851055737
COc1ccc(NC(=O)C2=CC3=[NH+][C@H](c4ccc(Cl)cc4)C[C@H](C(F)(F)F)N3N2)c(OC)c1,C03011410_decoy,WEE1,Decoy,0.0,-8.5686,-5.86,-2.16,-5.738604227483926
COc1ccc(NC(=O)C2=CC3=[NH+][C@H](c4ccc(Cl)cc4)C[C@@H](C(F)(F)F)N3N2)c(OC)c1,C03011415_decoy,WEE1,Decoy,0.0,-8.53778,-8.08,-2.78,-7.176444368137307
COC(=O)c1c(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)sc2c1CC(C)(C)[NH2+]C2(C)C,C36647923_decoy,WEE1,Decoy,0.0,-11.2896,-9.15,-3.56,-11.997657496988332
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NCc3ccc(-n4cc[nH+]c4C)cc3)ccc2C)cc1C,C38752825_decoy,WEE1,Decoy,0.0,-8.99385,-10.68,-3.05,-13.74106695449266
Cc1ccc2[nH]c(C(=O)N3CCC([C@@H](Cc4ccccc4)[NH+](C)CC4=CN(C)N[C@@H]4C)CC3)cc2c1,C39531942_decoy,WEE1,Decoy,0.0,-8.98845,-5.6,-4.74,-5.0890201162175455
Cc1ccc2[nH]c(C(=O)N3CCC([C@H](Cc4ccccc4)[NH+](C)CC4=CN(C)N[C@@H]4C)CC3)cc2c1,C39531944_decoy,WEE1,Decoy,0.0,-7.96136,-10.06,-3.05,-7.138447961001455
O=C(NCc1ccc(OC(F)(F)F)cc1)[C@H]1CN(C(=O)c2ccc3ccccc3c2)CC12CC[NH2+]CC2,C39599589_decoy,WEE1,Decoy,0.0,-8.14382,-6.37,-3.67,-5.870802960920394
Cc1ccc(CNC(=O)[C@H]2CN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC23CC[NH2+]CC3)cc1,C39634418_decoy,WEE1,Decoy,0.0,-8.46126,-6.8,-1.51,-5.451137379132017
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@H]3CCC[C@@H](C)[C@H]3C)C3(CC[NH2+]CC3)C2)cc1Cl,C39637477_decoy,WEE1,Decoy,0.0,-9.27972,-5.14,-4.9,-5.857006462084401
Cc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)[C@@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)cc1,C39639424_decoy,WEE1,Decoy,0.0,-7.06521,-6.13,-2.28,-5.999356465358642
COc1ccc(C(=O)N2C[C@H](C(=O)NCCc3ccc(C)cc3C)C3(CC[NH2+]CC3)C2)cc1C(F)(F)F,C39667111_decoy,WEE1,Decoy,0.0,-8.76512,-9.07,-3.21,-9.60544702770566
Cc1cccc(CNC(=O)[C@H]2CN(C(=O)[C@@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)c1C,C39667665_decoy,WEE1,Decoy,0.0,-8.9197,-10.77,-4.04,-8.636867636728155
COc1ccc(CC[C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3ccc(C)cc3C)CC23CC[NH2+]CC3)cc1,C39675449_decoy,WEE1,Decoy,0.0,-7.45048,-9.88,-1.67,-8.23032402021831
COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)N[C@@H](C)Cc3ccccc3F)C3(CC[NH2+]CC3)C2)cc1Cl,C39687146_decoy,WEE1,Decoy,0.0,-8.92482,-7.58,-2.27,-7.183531284328648
Cc1cccc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC23CC[NH2+]CC3)c1,C39689491_decoy,WEE1,Decoy,0.0,-8.68943,-9.4,-2.07,-7.637779916508796
CC[C@@H](C(=O)N1C[C@H](C(=O)NCc2cccc(-n3cccc3)c2)C2(CC[NH2+]CC2)C1)c1ccccc1,C39694141_decoy,WEE1,Decoy,0.0,-8.40298,-10.24,-2.68,-8.698093534834786
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,C43741657_decoy,WEE1,Decoy,0.0,-11.8846,-8.71,-5.35,-6.39566583637753
Cc1nc(-c2cnccn2)sc1[C@@H]1CSC[C@@H](C(=O)N[C@@H](C)c2cccc3ccccc23)[NH2+]1,C44166829_decoy,WEE1,Decoy,0.0,-10.5093,-6.88,-2.0,-7.696770778886506
O=C(NCC1CC[NH+](C2CCCC2)CC1)C(=O)Nc1ccc2c(c1)N(S(=O)(=O)c1cccs1)CCC2,C49509374_decoy,WEE1,Decoy,0.0,-9.39927,-7.77,-4.36,-6.923860772330616
CC1CC[NH+](Cc2cs/c(=N\C(=O)CSCc3nc4sc5c(c4c(=O)[nH]3)CCC5)[nH]2)CC1,C14526522_decoy,WEE1,Decoy,0.0,-11.051,-9.08,-1.97,-8.76876825256843
C/C(=N\NC(=[NH2+])S[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O)c1ccc(-c2ccccc2)cc1,C59489336_decoy,WEE1,Decoy,0.0,-9.32348,-6.46,-1.64,-5.360728145524874
O=C(Nc1cccc(F)c1)N1Cc2[nH]c[nH+]c2C[C@H]1c1nc(-c2ccc(C(F)(F)F)cc2)no1,C15675774_decoy,WEE1,Decoy,0.0,-7.07032,-6.01,-1.8,-4.1266061529825615
O=C(CCCNC(=O)N1CC[C@@H]2[C@@H](C1)N=C1C=CC(Cl)=C[C@@H]12)NCCC1=c2ccccc2=[NH+]C1,C63270967_decoy,WEE1,Decoy,0.0,-9.46002,-7.41,,99.0
O=C(O)c1ccc(N[C@@H]2[NH+]=c3ccccc3=N/C2=N\S(=O)(=O)c2ccc(Br)cc2)cc1,C39980223_decoy,WEE1,Decoy,0.0,-8.71204,-9.84,-1.45,-8.343736942502252
CCCCN1C(=O)[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O,C63376156_decoy,WEE1,Decoy,0.0,-8.8468,-5.72,-1.49,-4.599188741783077
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1c1ccc(F)c(Cl)c1,C63458321_decoy,WEE1,Decoy,0.0,-8.63322,-7.44,-2.48,-5.088684998336268
O=C1[C@H]2[C@@H](C(=O)N1C1CCCCC1)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccc(Cl)cc21,C63472945_decoy,WEE1,Decoy,0.0,-9.34563,-6.62,-2.96,-5.593560257584649
Cc1ccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@@]4(C(=O)Nc5ccc(F)cc54)[C@@H]3C2=O)cc1,C63480012_decoy,WEE1,Decoy,0.0,-9.67311,-6.37,-3.09,-5.441263789960487
Cc1cccc2c1NC(=O)[C@]21N[C@H](CC2=c3ccccc3=[NH+]C2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]21,C63480288_decoy,WEE1,Decoy,0.0,-9.42696,-6.4,-3.41,-6.088562492051121
CN(C)c1ccc([C@H](CNC(=O)CN2C(=O)NC3(CCCC3)C2=O)C2=c3ccccc3=[NH+]C2)cc1,C63819104_decoy,WEE1,Decoy,0.0,-8.4376,-8.67,-3.74,-8.546011344279002
COc1ccc([C@H](CNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)C2=c3ccccc3=[NH+]C2)cc1,C63830752_decoy,WEE1,Decoy,0.0,-8.60191,-10.06,-2.62,-8.7507770658688
CC(=O)Nc1ccc(NC(=O)CSc2nnc(C3=c4ccccc4=[NH+]C3)n2-c2ccc(Cl)cc2)cc1,C63919923_decoy,WEE1,Decoy,0.0,-8.69758,-9.26,-1.51,-7.584371644713215
CC1=C(C(=O)N2CCC(CC(=O)NCCC3=c4ccccc4=[NH+]C3)CC2)CN(c2ccccc2)N1,C64518594_decoy,WEE1,Decoy,0.0,-9.2255,-7.45,-4.27,-6.862663817650067
COc1cccc(CNC2=[NH+]CCNC23CCN(S(=O)(=O)c2ccc4c(c2)CCCC4)CC3)c1,C65074802_decoy,WEE1,Decoy,0.0,-9.59372,-8.85,-3.38,-8.646703429024742
CC(C)c1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccc3c(c2)OCO3)cc1,C65074841_decoy,WEE1,Decoy,0.0,-9.53421,-8.11,-2.21,-9.425046062944997
CC(C)Cc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2ccc3c(c2)OCO3)cc1,C65074856_decoy,WEE1,Decoy,0.0,-9.07875,-5.77,-3.27,-4.979292679582324
C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@H](O)C[C@]2(C)[C@]1(O)C(=O)COC(=O)C(C)(C)C,C04964122_decoy,WEE1,Decoy,0.0,-6.2434,-6.74,-3.96,-3.5690476290840665
C[C@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@H](O)C[C@]2(C)[C@]1(O)C(=O)COC(=O)C(C)(C)C,C04964123_decoy,WEE1,Decoy,0.0,-7.84328,-4.63,-2.86,-5.175004806733777
NC1=C(C(=O)c2ccccc2)[C@H](c2ccc3c(c2)OCO3)C2=C(CCCC2=O)N1c1ccc(Cl)cc1,C02972395_decoy,WEE1,Decoy,0.0,-8.12099,-5.64,-3.29,-5.043771387458777
O=C1OC(c2ccc(NC(=O)C(F)(F)F)cc2)(c2ccc(NC(=O)C(F)(F)F)cc2)c2ccccc21,C08435189_decoy,WEE1,Decoy,0.0,-6.64088,-5.29,-1.0,-4.0041864689851225
O=C(CSc1nc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2s1)NC[C@@H]1CCCO1,C00716531_decoy,WEE1,Decoy,0.0,-10.2357,-8.45,-2.91,-7.606251362776106
O=C(CSc1nc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2s1)NC[C@H]1CCCO1,C00716530_decoy,WEE1,Decoy,0.0,-11.5692,-8.98,-2.47,-8.517691130829405
Cc1ccccc1[C@@H]1C(C#N)=C(N)N(c2cc([N+](=O)[O-])ccc2C)C2=C1C(=O)C[C@H](c1ccccc1)C2,C00695909_decoy,WEE1,Decoy,0.0,-8.23045,-5.29,-1.74,-5.136428579827142
C/C(=N\NC(=O)[C@]1(C)CC1(Cl)Cl)c1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)cc1,C08455980_decoy,WEE1,Decoy,0.0,-10.2099,-8.58,-2.1,-7.290735995957257
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1cn(-c2ccccc2)nc1C12CC3CC(CC(C3)C1)C2,C08721074_decoy,WEE1,Decoy,0.0,-8.41579,-6.46,-1.52,-5.546959264244018
Cc1cc(C)c(NC(=O)CSc2nnc(NC(=O)c3ccc(Br)cc3)s2)c(C)c1,C08822609_decoy,WEE1,Decoy,0.0,-9.49801,-8.96,-3.43,-8.134422392367165
COC(=O)c1c(N2C(N)=C(C#N)[C@@H](c3ccc(F)cc3)C3=C2CC(C)(C)CC3=O)sc2c1CCCCC2,C02188836_decoy,WEE1,Decoy,0.0,-7.08188,-5.07,-1.79,-4.2674471899680055
O=C(Nc1ccc(Br)cc1)[C@@H]1Sc2nnc(-c3ccccc3)n2N[C@@H]1c1ccccc1,C09236942_decoy,WEE1,Decoy,0.0,-7.89488,-5.0,-1.86,-4.863517828321922
O=C(Nc1ccc(Br)cc1)[C@H]1Sc2nnc(-c3ccccc3)n2N[C@@H]1c1ccccc1,C09236947_decoy,WEE1,Decoy,0.0,-8.26276,-9.85,-2.85,-8.132634491277594
O=C(CSc1nnc(NC(=O)c2ccc3ccccc3c2)s1)Nc1ccc(Br)cc1,C09368314_decoy,WEE1,Decoy,0.0,-8.75967,-9.93,-1.7,-7.615707896851875
Nn1c(COc2cccc(Br)c2)nnc1SCc1csc(-c2ccc(F)cc2)n1,C09464342_decoy,WEE1,Decoy,0.0,-10.1243,-5.91,-1.66,-5.9386572526438846
CCOC(=O)c1c(N2C(N)=C(C#N)[C@@H](c3ccccc3)C3=C2CC(C)(C)CC3=O)sc2c1CCCC2,C03664910_decoy,WEE1,Decoy,0.0,-8.03034,-5.63,-1.98,-4.420506813479055
O=C(CSc1nc(C2CCCCC2)n(-c2ccccc2)n1)NC(=O)NC12CC3CC(CC(C3)C1)C2,C14357907_decoy,WEE1,Decoy,0.0,-9.13784,-8.21,-3.61,-8.326290390745802
COc1ccc(Br)cc1C(=O)NC(=S)Nc1cccc(C(=O)N2CCCCCC2)c1,C14556924_decoy,WEE1,Decoy,0.0,-9.10499,-8.6,-2.85,-8.370961953090516
C=CCOc1c(I)cc(/C=C2\C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)cc1OC,C19853735_decoy,WEE1,Decoy,0.0,-9.32353,-9.09,-1.07,-2.620528407856613
Cc1cc(NC(=S)Nc2cc(S(=O)(=O)N3CCC(C)CC3)ccc2N2CCC(C)CC2)ccc1Cl,C20724283_decoy,WEE1,Decoy,0.0,-10.6598,-9.08,-1.91,-8.993600430389934
Cc1ccc(-n2nc(C)c(NC(=O)CSc3ncc(-c4ccc(Br)cc4)[nH]3)c2C)cc1,C23292338_decoy,WEE1,Decoy,0.0,-9.45579,-9.2,-1.34,-8.619283061631965
Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)[C@@H](NC(=O)c1c(F)cccc1F)C(C)C,C23482006_decoy,WEE1,Decoy,0.0,-7.42478,-8.68,-3.0,-4.86136774452495
Cc1nn(-c2ccc(Br)cc2)c2c1C(c1ccc(OCc3ccccc3)cc1)=C(C#N)[C@@H](N)O2,C27552043_decoy,WEE1,Decoy,0.0,-10.2319,-8.6,-1.5,-7.383702327532744
O=C(NCc1ccccc1)Nc1ccc(N2CCC(Cc3ccccc3)CC2)c(C(=O)N2CCCC2)c1,C00735867_decoy,WEE1,Decoy,0.0,-8.56527,-9.89,-3.54,-8.10743770227362
Cc1cccc(NC(=O)[C@H]2[C@H]3C(=O)N(C4CCCCCC4)[C@H](C(=O)N[C@@H]4CCCC[C@@H]4C)[C@]34C=C[C@H]2O4)c1,C34849269_decoy,WEE1,Decoy,0.0,-9.454,-9.58,-3.34,-7.223755017381985
CC[C@@H](C(=O)N1CCC(C(=O)N[C@H]2CCCC[C@H]2NC(=O)c2ccccc2C)CC1)c1ccccc1,C34899740_decoy,WEE1,Decoy,0.0,-8.69431,-6.97,-3.58,-6.05415539111153
CC[C@H](C(=O)N1CCC[C@H](C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccc(F)cc2)C1)c1ccccc1,C34900202_decoy,WEE1,Decoy,0.0,-8.24503,-10.33,-2.86,-6.511648993399524
O=C(N[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCN(C(=O)c2ccc(-c3ccccc3)cc2)C1)c1ccc(F)cc1,C34900218_decoy,WEE1,Decoy,0.0,-8.97154,-6.3,-2.89,-5.426762090004672
CC(C)c1ccc(C(=O)NC(=S)Nc2ccc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)cc2)cc1,C35403689_decoy,WEE1,Decoy,0.0,-9.71426,2.43,-3.74,-2.602622349756452
O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1nnc(-c2ccccc2)s1)c1ccc(Br)cc1,C35723431_decoy,WEE1,Decoy,0.0,-8.87152,-8.17,-1.22,-12.811604389335535
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@@H]1c1cccc(NC(=O)c2cccc(Br)c2)c1,C35729677_decoy,WEE1,Decoy,0.0,-8.06491,-9.13,-2.37,-8.429389501573095
CC[C@@H](C(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2C)C1)c1ccccc1,C35955598_decoy,WEE1,Decoy,0.0,-8.72028,-8.67,-3.64,-6.967481553107231
Nn1c(SCc2nc(-c3cccc(C(F)(F)F)c3)no2)nnc1-c1ccccc1Br,C36646604_decoy,WEE1,Decoy,0.0,-8.98224,-9.87,-4.02,-7.666457761844105
Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(Br)cc1,C38651669_decoy,WEE1,Decoy,0.0,-8.26396,-6.57,-1.31,-4.907557050648252
C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(Br)cc1,C38651702_decoy,WEE1,Decoy,0.0,-8.86368,-10.57,-0.84,-8.39275632163489
Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1Br,C38678571_decoy,WEE1,Decoy,0.0,-10.1989,-9.57,-1.17,-9.77075676818765
CSc1nnc(N2C(N)=C(C#N)[C@H](c3c(Cl)cccc3Cl)C3=C2CC(C)(C)CC3=O)s1,C39426047_decoy,WEE1,Decoy,0.0,-8.83238,-4.6,-0.9,-4.581757254473426
C[C@H]1CCc2c(sc(NC(=O)/C=C/c3ccc(C(C)(C)C)cc3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C39836232_decoy,WEE1,Decoy,0.0,-11.0973,-9.65,-4.0,-9.991393898746402
C[C@H]1CCc2c(sc(NC(=O)Cc3cccc4ccccc34)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C39836294_decoy,WEE1,Decoy,0.0,-10.4242,-10.79,-2.6,-10.800898981400438
Cc1ccc(/C=C/C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CC[C@@H](C(C)(C)C)C3)cc1,C39836469_decoy,WEE1,Decoy,0.0,-10.2218,-10.2,-1.96,-9.969202851248696
CC(C)(C)c1ccc2occ(CC(=O)Nc3sc4c(c3C(=O)NC[C@H]3CCCO3)CCCC4)c2c1,C39883543_decoy,WEE1,Decoy,0.0,-8.76793,-9.76,-1.9,-9.200481223074856
C=CC(C)(C)[C@]12C[C@@H]3C(=O)N4[C@H]5Nc6ccccc6[C@]5(C(C)(C)C=C)C[C@H]4C(=O)N3[C@@H]1Nc1ccccc12,C35455805_decoy,WEE1,Decoy,0.0,-9.33884,-5.33,-1.91,-5.040583904772372
CNC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(-c3cccc(Br)c3)o2)sc2c1CCCC2,C39992755_decoy,WEE1,Decoy,0.0,-9.32305,-8.3,-1.21,-10.83991851211236
CCCCC1CCC(C(=O)Nc2sc3c(c2C(=O)N[C@@H]2CCS(=O)(=O)C2)CC[C@H](C)C3)CC1,C40038601_decoy,WEE1,Decoy,0.0,-11.1105,-8.19,-2.76,-9.34972705124796
Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1/C(=N/NC(=O)c1ccc(Br)cc1)CCC2,C40811821_decoy,WEE1,Decoy,0.0,-8.53265,-10.06,-2.75,-9.888994275700703
C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)C2=O,C22989472_decoy,WEE1,Decoy,0.0,-7.3678,-10.2,-2.02,-7.657210693830829
C[C@@H]1C[C@H]2[C@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@]3(F)[C@H](O)C[C@]2(C)[C@]1(O)C(=O)COC(=O)C(C)(C)C,C43757652_decoy,WEE1,Decoy,0.0,-8.20822,-5.73,-2.95,-4.3631525169293495
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CNC(=O)c1cccc(Br)c1,C45781596_decoy,WEE1,Decoy,0.0,-8.35006,-7.32,-2.67,-6.192329519902578
O=C(CNc1c(Br)cc(Br)cc1Br)N/N=C/c1ccc2c(c1)OCO2,C01052587_decoy,WEE1,Decoy,0.0,-8.59063,-7.44,-0.75,-6.595745923255277
O=C(Nc1ccc(F)cc1)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1,C59131764_decoy,WEE1,Decoy,0.0,-8.19067,-9.41,-2.52,-7.215705869781902
N#CC1=C(N)N(c2sc3c(c2C#N)CCCCC3)C2=C(C(=O)CCC2)[C@H]1c1ccc([N+](=O)[O-])cc1,C03665044_decoy,WEE1,Decoy,0.0,-8.46576,-5.74,-3.2,-4.700330371908199
COc1cccc([C@H]2C(C#N)=C3N=C(N)c4c(sc5c4CCCCC5)N3C3=C2C(=O)CC(C)(C)C3)c1OC,C03669589_decoy,WEE1,Decoy,0.0,-9.36255,-5.23,-2.14,-4.632338968619649
O=C(Nc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1,C08883081_decoy,WEE1,Decoy,0.0,-8.54277,-9.34,-1.65,-7.33424512382998
COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCc2sc(NC(=O)c3ccc4c(c3)OCO4)nc21,C09104733_decoy,WEE1,Decoy,0.0,-9.0426,-6.11,-2.7,-5.384393225083989
O=C(CSc1nnc(-c2ccccc2Br)o1)NC(=O)NC12CC3CC(CC(C3)C1)C2,C09120365_decoy,WEE1,Decoy,0.0,-10.2495,-8.11,-1.92,-8.154592589127475
Cc1cc(C)c(OCC(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CCCC3)c(C)c1,C09171853_decoy,WEE1,Decoy,0.0,-9.18821,-9.06,-1.82,-14.713045276215349
COC(=O)c1ccc([C@H]2Nn3c(nnc3-c3ccccc3)S[C@@H]2C(=O)Nc2ccc(C)cc2)cc1,C09236266_decoy,WEE1,Decoy,0.0,-8.7392,-5.48,-0.64,-5.810921051567865
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/c3ccco3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C09281079_decoy,WEE1,Decoy,0.0,-10.7141,-9.43,-1.74,-10.03929237267029
O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccc2c(c1)S(=O)(=O)N=C1CCCCCN12,C09283781_decoy,WEE1,Decoy,0.0,-9.58864,-11.29,-0.97,-9.558166504828648
O=c1cc(Cc2nnc(SCc3ccc(Br)cc3)n2-c2ccc(F)cc2)[nH]c(=O)[nH]1,C09382053_decoy,WEE1,Decoy,0.0,-8.30838,-7.84,-1.34,-8.12517311188492
O=C(Nc1c(C(=O)Nc2ccc(OC(F)(F)F)cc2)oc2ccccc12)c1ccc2c(c1)OCO2,C09518361_decoy,WEE1,Decoy,0.0,-7.77106,-10.95,-0.98,-9.455037773684372
CCOC(=O)C1=C(N)OC2=C(C(=O)CC(C)(C)C2)[C@]12C(=O)N1c3c(cc(OC)cc32)C(C)=CC1(C)C,C09846918_decoy,WEE1,Decoy,0.0,-7.49828,-4.77,-1.96,-4.415489387446461
O=C(Nc1nc2cc3c(cc2s1)OCCO3)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1,C11752059_decoy,WEE1,Decoy,0.0,-8.2838,-11.05,-2.18,-7.70689643609943
O=C(Nc1nc2cc3c(cc2s1)OCCO3)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1,C11752331_decoy,WEE1,Decoy,0.0,-8.78815,-11.1,-3.93,-13.009609900818347
CC1(C)CC(=O)C2=C(C1)N(c1ccc(F)c([N+](=O)[O-])c1)C(N)=C(C#N)[C@@H]2c1ccc(Br)cc1,C01065102_decoy,WEE1,Decoy,0.0,-7.25721,-4.97,-0.87,-3.474666167440704
O=C(Cc1csc(-c2ccc(F)cc2)n1)NN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O,C13114597_decoy,WEE1,Decoy,0.0,-8.52118,-9.68,-1.01,-9.712253049183548
CCC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)c2C#N)C1,C14240889_decoy,WEE1,Decoy,0.0,-9.32016,-8.31,-2.69,-7.231239740258349
CCC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)c2C#N)C1,C14240891_decoy,WEE1,Decoy,0.0,-9.76978,-9.18,-1.48,-8.108902564145565
Cc1cc(C)c2oc(-c3ccc(Cl)c(NC(=S)NC(=O)c4ccc5c(c4)OCCO5)c3)nc2c1,C14274079_decoy,WEE1,Decoy,0.0,-9.68874,-9.61,-2.64,-7.90645100980442
CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc(-c4ccc(C)s4)nc4onc(C)c34)n2)cc1,C10642449_decoy,WEE1,Decoy,0.0,-10.573,-9.56,-2.33,-9.355496623843983
Cc1cc(C)c(NC(=O)CNC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(C)c1,C15620658_decoy,WEE1,Decoy,0.0,-9.16656,-9.53,-3.05,-6.677730132639228
Cc1cccc(C)c1OCC(=O)Nc1sc2c(c1C(=O)N[C@@H]1CCS(=O)(=O)C1)CC[C@@H](C)C2,C16741976_decoy,WEE1,Decoy,0.0,-9.58092,-9.63,-2.99,-10.113254202330694
NC(=O)c1ccc(CSc2nc3sc4c(c3c(=O)n2C2CCCC2)CCCC4)c([N+](=O)[O-])c1,C16801287_decoy,WEE1,Decoy,0.0,-7.89204,-9.0,-3.15,-9.232865485253736
Cc1c(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)oc2ccccc12,C17448316_decoy,WEE1,Decoy,0.0,-9.1305,-11.17,-1.81,-8.01611485654954
COC(=O)C1=C(N)C(C(=O)OC)=c2s/c(=C/c3ccccc3F)c(=O)n2[C@H]1c1ccccc1F,C20459039_decoy,WEE1,Decoy,0.0,-7.78689,-4.68,-1.43,-4.775475173878911
O=[N+]([O-])c1ccc(O)c([C@H]2Nc3ccc(S(=O)(=O)N4CCc5ccccc54)cc3[C@@H]3C=CC[C@@H]23)c1,C20709209_decoy,WEE1,Decoy,0.0,-8.07202,-8.01,-2.64,-5.914563227335242
O=C(CNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1)Nc1ccc(F)c(F)c1,C23115838_decoy,WEE1,Decoy,0.0,-10.1557,-10.42,-3.68,-9.015171653767617
C[C@@H]1CCc2c(sc3nc(S[C@H](C)c4nc(N)nc(N(C)C)n4)n(-c4ccccc4)c(=O)c23)C1,C24882652_decoy,WEE1,Decoy,0.0,-10.0036,-7.52,-2.84,-8.709266994113998
CSc1sc(C)cc1[C@H]1C(C#N)=C(N)N(c2ccc([N+](=O)[O-])cc2Cl)C2=C1C(=O)CCC2,C27550433_decoy,WEE1,Decoy,0.0,-9.35484,-5.2,-1.94,-5.38222962064084
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)N[C@H](C)c3ccc4c(c3)OCCCO4)c2)cc1F,C32284615_decoy,WEE1,Decoy,0.0,-9.05499,-5.59,-3.53,-5.156534758188953
O=C1C[C@@H](C(F)(F)F)N(C(=O)CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)c2ccccc2N1,C32878689_decoy,WEE1,Decoy,0.0,-7.02122,-6.49,-1.61,-4.773683573752065
COc1ccc(C)cc1NC(=O)N1CCC[C@H](c2nnc(C(=O)Nc3cccc(Cl)c3)s2)C1,C33113448_decoy,WEE1,Decoy,0.0,-9.47164,-8.96,-2.65,-7.869377480612112
CC[C@@H]1Oc2cc(S(=O)(=O)N3CCC(C(=O)Nc4ccc(C)cc4C)CC3)c(C)cc2NC1=O,C33252477_decoy,WEE1,Decoy,0.0,-7.59188,-8.57,-2.16,-9.991527776356545
Cc1cc(C)cc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)n3nc(N)c5c(C(F)(F)F)cc(C)nc53)[C@@H]4C2=O)c1,C34095350_decoy,WEE1,Decoy,0.0,-8.18323,-6.51,-2.02,-5.577572256904669
CC[C@@H](C)[C@H](NC(=O)NC12CC3CC(CC(C3)C1)C2)C(=O)N1CCN(C(=O)c2ccccc2)[C@H](C)C1,C34979902_decoy,WEE1,Decoy,0.0,-8.63228,-6.2,-4.47,-4.506831272373396
O=C(Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O,C35351268_decoy,WEE1,Decoy,0.0,-8.68815,-10.14,-2.06,-7.377854435070207
Cc1ccc(NC(=O)N2CCN(c3ccc(NC(=O)C(C)C)cc3C(=O)N3CCCCC3)CC2)cc1,C36019585_decoy,WEE1,Decoy,0.0,-8.74834,-8.46,-3.37,-7.7813329514042096
Cc1ccc(N2C(=O)[C@H]3[C@H](C)N[C@@]4(C(=O)N(CC(=O)Nc5ccccc5)c5ccccc54)[C@@H]3C2=O)cc1,C20807609_decoy,WEE1,Decoy,0.0,-8.14368,-6.16,-1.35,-4.606453957224479
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)sc2c1CC[C@@H](C)C2,C37593613_decoy,WEE1,Decoy,0.0,-10.7816,-8.02,-1.34,-7.276089678886893
CNC(=O)c1cccc(NC(=O)Cn2c(=O)c(N3C[C@]4(C)C[C@H]3CC(C)(C)C4)nc3ccccc32)c1,C34867669_decoy,WEE1,Decoy,0.0,-8.31447,-10.82,-1.26,-9.904787515397729
Cc1nn(Cn2nc(C)c(NC(=O)Nc3ccc(Br)cc3)c2C)c(C)c1Br,C39967620_decoy,WEE1,Decoy,0.0,-7.96227,-8.12,-1.81,-9.771435572439646
COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NS(=O)(=O)c1ccc(F)cc1)CCC2,C40826043_decoy,WEE1,Decoy,0.0,-9.2745,-10.0,-2.19,-8.368167770721831
Cc1cccc2cc(C(=O)Nc3sc4c(c3C(=O)N[C@@H]3CCS(=O)(=O)C3)CC[C@@H](C)C4)oc12,C41313882_decoy,WEE1,Decoy,0.0,-10.3471,-10.64,-1.49,-10.379615217236443
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)C12C[C@H]3C[C@@H](C1)CC(c1ccccc1)(C3)C2,C16805233_decoy,WEE1,Decoy,0.0,-8.87712,-10.15,-2.92,-8.630473020895826
O=C1C[C@@H](c2cccs2)CC2=C1[C@H](c1cccc([N+](=O)[O-])c1)c1c([nH]n(-c3ccccc3)c1=O)N2,C18196881_decoy,WEE1,Decoy,0.0,-8.44795,-6.38,-1.99,-4.64484008845244
Cc1ccc([C@H]2CC(=O)C3=C(C2)Nc2[nH]n(-c4ccccc4)c(=O)c2[C@H]3c2cccc([N+](=O)[O-])c2)cc1,C10325894_decoy,WEE1,Decoy,0.0,-8.27744,-6.35,-2.89,-5.211484476247849
Cc1ccc([C@H]2CC(=O)C3=C(C2)Nc2[nH]n(-c4ccccc4)c(=O)c2[C@@H]3c2cccc([N+](=O)[O-])c2)cc1,C10325912_decoy,WEE1,Decoy,0.0,-7.56538,-5.48,-2.52,-4.689558375166306
O=C(Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1)[C@H]1C(=O)N(Cc2ccco2)[C@@H]2CCCCC2=C1O,C63426686_decoy,WEE1,Decoy,0.0,-9.21368,-7.66,-2.02,-9.865318361294795
N#CC1=C(N)OC2=NN=C(c3ccccc3)[C@@H]2[C@]12C(=O)N(Cc1cccc3ccccc13)c1ccccc12,C09281664_decoy,WEE1,Decoy,0.0,-6.47424,-5.36,-2.5,-3.5210786851935136
Cc1ccc(N2C(=O)[C@@H]3Sc4c(sc(=O)n4CC(=O)Nc4ccc(O)cc4)C(C)(C)[C@H]3C2=O)cc1,C15087694_decoy,WEE1,Decoy,0.0,-10.1738,-8.71,-3.43,-8.812539800746
COc1ccc(C(=O)Nc2nc3c(s2)C[C@]2(C)CC[C@@H]([C@H](C)C(=O)N4CCCC4)[C@H](O)[C@H]2[C@@H]3C)cc1,C03840804_decoy,WEE1,Decoy,0.0,-9.05257,-9.16,-2.78,-7.110070707847962
COc1ccc(C(=O)Nc2nc3c(s2)C[C@]2(C)CC[C@H]([C@H](C)C(=O)N4CCSCC4)[C@H](O)[C@H]2[C@@H]3C)cc1,C04222007_decoy,WEE1,Decoy,0.0,-10.1185,-9.19,-2.31,-7.94639630936917
C=CCN(C)C(=O)[C@@H](C)[C@H]1CC[C@]2(C)Cc3sc(NC(=O)c4ccc5c(c4)OCO5)nc3[C@@H](C)[C@@H]2[C@H]1O,C04222050_decoy,WEE1,Decoy,0.0,-9.42117,-9.61,-2.28,-7.900924613302458
O=C(N[C@@H]1CCS(=O)(=O)C1)/C(=C/c1ccc(-c2ccc(Cl)cc2)o1)NC(=O)c1ccc(Cl)cc1,C02677912_decoy,WEE1,Decoy,0.0,-9.73831,-5.52,-2.47,-6.095026142107989
O=C(NC(=S)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1)c1ccc(Br)o1,C01129283_decoy,WEE1,Decoy,0.0,-10.0343,-9.47,-3.34,-9.066804367041795
O=C(CSc1nnc(NC(=O)c2ccc(Br)cc2)s1)Nc1ccc2c(c1)OCCO2,C08822617_decoy,WEE1,Decoy,0.0,-9.56825,-6.56,-1.76,-5.8138888227132615
COC(=O)NC(=O)c1c(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)sc2c1CC[C@@H](C)C2,C08893902_decoy,WEE1,Decoy,0.0,-10.2805,-8.97,-3.64,-9.406641461389183
CSc1ncc(Br)c(C(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)n1,C08915221_decoy,WEE1,Decoy,0.0,-11.0381,-7.88,-2.39,-9.704003166467256
Cc1ccc(S(=O)(=O)NC(=O)N(O)[C@H]2N(Cc3ccc4c(c3)OCO4)C(=S)SC2(C)C)cc1,C04244509_decoy,WEE1,Decoy,0.0,-7.65825,-6.99,-3.51,-7.218277242617401
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@@H](C)C(=O)Nc3ccc(Br)c(C)c3)CC2)cc1,C09459673_decoy,WEE1,Decoy,0.0,-9.41186,-9.39,-3.67,-7.579679443521492
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2)sc2c1CCCC2,C09599725_decoy,WEE1,Decoy,0.0,-10.273,-6.04,-1.36,-5.488402901395793
Cc1ccc(N2C[C@H](C(=O)Nc3nc(CC(=O)Nc4nc5ccc(C)cc5s4)cs3)CC2=O)cc1,C09698937_decoy,WEE1,Decoy,0.0,-10.2664,-9.46,-4.83,-8.312510667825142
Cc1ccc2nc(NC(=O)Cc3csc(NC(=O)[C@@H]4CC(=O)N(c5ccc(F)cc5)C4)n3)sc2c1,C09700031_decoy,WEE1,Decoy,0.0,-10.8308,-9.01,-2.36,-8.179947312637326
COC(=O)NC(=O)c1c(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)sc2c1CC[C@@H](C)C2,C10785856_decoy,WEE1,Decoy,0.0,-9.71435,-7.05,-3.02,-8.871898299929326
COC(=O)NC(=O)c1c(NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)sc2c1CCCC2,C11130107_decoy,WEE1,Decoy,0.0,-9.64825,-8.63,-4.56,-7.570752261797758
O=C(Nc1cc(-c2ccco2)nn1-c1nc2c(c(=O)[nH]1)CCCC2)C1c2ccccc2Oc2ccccc21,C12010498_decoy,WEE1,Decoy,0.0,-8.32321,-10.97,-5.56,-9.29956355389079
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1,C12537880_decoy,WEE1,Decoy,0.0,-8.27016,-6.84,-5.33,-4.941487066776679
C[C@]12CC/C(=N/NC(=O)c3ccncc3)C[C@@H]1CC[C@@H]1[C@H]2CC[C@]2(C)/C(=N/NC(=O)c3ccncc3)CC[C@H]12,C12659004_decoy,WEE1,Decoy,0.0,-9.45486,-5.76,-2.75,-6.062400934656108
CC(=O)Nc1ccc(Sc2nc3ccccc3nc2NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1,C12767545_decoy,WEE1,Decoy,0.0,-10.6455,-9.61,-2.37,-9.207114557873911
N#CC1=C(N)N(c2ccc([N+](=O)[O-])cc2Cl)C2=C(C(=O)CCC2)[C@@H]1c1cc(Br)cs1,C13917351_decoy,WEE1,Decoy,0.0,-8.50285,-4.67,-0.63,-5.021967168293114
CCOC(=O)C1=C(N)OC2=C(C(=O)CC(C)(C)C2)[C@@]12C(=O)N1c3c(cc(F)cc32)[C@@H](C)CC12CCCC2,C14162302_decoy,WEE1,Decoy,0.0,-6.39807,-6.24,-2.35,-3.2153175020967453
CCCNC(=O)C(=O)N/N=C/C12c3ccccc3C(c3ccccc31)[C@@H]1C(=O)N(c3ccc(C)cc3)C(=O)[C@@H]12,C15133785_decoy,WEE1,Decoy,0.0,-9.73765,-5.3,-3.29,-2.287556831515852
COC(=O)c1ccc([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(Cc2ccccc2F)c2ccccc23)cc1,C20558540_decoy,WEE1,Decoy,0.0,-9.59755,-5.89,-1.41,-6.620263829066281
Cc1ccc(C(=O)N2CCN(c3ccc(NC(=S)NC(=O)c4ccc5nsnc5c4)cc3)CC2)cc1,C21595749_decoy,WEE1,Decoy,0.0,-9.0758,-7.02,-2.53,-5.0378771302365255
C/C(=C\c1csc(C)n1)[C@@H]1C[C@H]2O[C@]2(C)CCC[C@H](C)[C@@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1,C22058344_decoy,WEE1,Decoy,0.0,-9.42155,-5.49,-1.38,-5.158884734779488
O=C1C(NNC(=O)c2ccccc2)=CC(=NS(=O)(=O)c2ccc(Br)cc2)C2=C1CC=CC2,C26786641_decoy,WEE1,Decoy,0.0,-8.34682,-8.93,-1.36,-7.331077965102008
Cc1ccc(S(=O)(=O)c2nc(S(=O)(=O)c3ccc(C)cc3)c(N3CCC(C(N)=O)CC3)s2)cc1,C32609573_decoy,WEE1,Decoy,0.0,-10.258,-8.75,-3.5,-8.173386334758318
[H]/N=c1/c(=C/c2cc(C)n(-c3ccc([C@H](C)CC)cc3)c2C)c(=O)nc2s/c(=C/C(=O)N3CCCCC3)[nH]n1-2,C33705185_decoy,WEE1,Decoy,0.0,-10.9089,-7.69,-2.07,-7.065091280927853
N#CC1=C2C=CN(C(=O)OCc3ccccc3)C[C@H]2[C@@H](c2ccccc2C(F)(F)F)C(C#N)(C#N)[C@@H]1N,C33825844_decoy,WEE1,Decoy,0.0,-6.73282,-4.89,-1.55,-4.522269741218207
Cc1ccc2c(c1)[C@]1(C(=O)N2)[C@H](C(=O)c2cccc([N+](=O)[O-])c2)[C@]2(C(=O)Nc3ccccc32)[C@H]2CCCN21,C34808479_decoy,WEE1,Decoy,0.0,-7.51304,-6.51,-2.14,-4.772797733299864
Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3ccc(S(=O)(=O)N4C[C@@H](C)C[C@H](C)C4)cc3)C2=O)cc1,C34863248_decoy,WEE1,Decoy,0.0,-8.54229,-10.08,-4.83,-7.877176150986787
Cc1ccc(C(=O)N2CCN(C(=O)[C@H](NC(=O)Nc3ccccc3Br)C(C)C)C[C@@H]2C)cc1,C34975277_decoy,WEE1,Decoy,0.0,-6.69478,-6.06,-2.97,-5.007841546140586
Cc1cccc(NC(=O)[C@@H]2[C@H]3C(=O)N(Cc4cccs4)[C@H](C(=O)N[C@@H]4CCC[C@H](C)[C@@H]4C)[C@]34C=C[C@H]2O4)c1,C35201758_decoy,WEE1,Decoy,0.0,-9.5828,-8.27,-2.78,-6.802154952838386
CN(C)c1ccc(-c2nnc(NC(=O)[C@@H]3CCCN3C(=O)Nc3ccc(Br)cc3)s2)cc1,C35729091_decoy,WEE1,Decoy,0.0,-9.19885,-8.66,-1.65,-7.938900812521687
Cc1ccc(NC(=O)N2CCN(c3ccc(NC(=O)C4CCCC4)cc3C(=O)N3CCCCC3)CC2)cc1,C36019590_decoy,WEE1,Decoy,0.0,-9.65796,-8.42,-2.58,-7.145308646704375
CC(=O)c1cccc(N2C(=O)[C@H]3[C@@H](C(=O)Nc4ccccc4)[C@@]4(C)C=C[C@@]3(O4)[C@H]2C(=O)NC2CCCCC2)c1,C33939859_decoy,WEE1,Decoy,0.0,-8.69525,-9.24,-3.82,-9.16409429768622
Cc1cccc2c(=O)cc(C(=O)Nc3sc4c(c3C(=O)N[C@H]3CCS(=O)(=O)C3)CC[C@@H](C)C4)oc12,C38644092_decoy,WEE1,Decoy,0.0,-9.85547,-10.4,-3.41,-9.867458276869332
COc1ccc(/C=C2\CN(C(C)=O)CC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(OC)cc2OC)c(OC)c1,C39326705_decoy,WEE1,Decoy,0.0,-8.83836,-5.07,-1.03,-6.126215182467633
C[C@H]1CCc2c(sc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C39836238_decoy,WEE1,Decoy,0.0,-9.5309,-10.57,-1.63,-10.72480021577625
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3ccccc3[N+](=O)[O-])c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C39836487_decoy,WEE1,Decoy,0.0,-8.51983,-8.52,-3.64,-8.861579280842502
COc1ccc2occ(CC(=O)Nc3sc4c(c3C(=O)N[C@H]3CCS(=O)(=O)C3)CC[C@@H](C)C4)c2c1,C39883116_decoy,WEE1,Decoy,0.0,-9.84546,-9.64,-1.46,-9.822888010405649
C/C(=C\c1csc(C)n1)[C@@H]1C[C@@H]2O[C@@]2(C)CCC[C@H](C)[C@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1,C39937073_decoy,WEE1,Decoy,0.0,-10.6652,-6.11,-1.75,-4.813045112892367
COC(=O)c1ccc(NC(=O)N2CCN(C(=O)C3CCCC3)[C@@H](C(=O)N[C@H]3CCCc4ccccc43)C2)cc1,C44176508_decoy,WEE1,Decoy,0.0,-8.41607,-9.84,-4.11,-7.990942332931517
CC(C)(C)c1ccc(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)C[C@H]2C(=O)NC[C@H]2CCCO2)cc1,C44176542_decoy,WEE1,Decoy,0.0,-8.20924,-5.76,-2.31,-5.861723088532215
[H]/N=c1/c(=C/c2ccc(OCc3ccc(Br)cc3)c(OC)c2)c(=O)nc2s/c(=C\CC)[nH]n1-2,C01822298_decoy,WEE1,Decoy,0.0,-9.99885,-6.93,-2.21,-6.4912537555425285
C[C@H]1CCc2nc(SCc3nnc(CSc4nc5c(cc4C#N)C[C@@H](C)CC5)n3N)c(C#N)cc2C1,C58835069_decoy,WEE1,Decoy,0.0,-9.92799,-9.86,-2.49,-10.810208764745216
COC(=O)C1=C(C)OC(N)=C(C#N)[C@@]12C(=O)N(CC(=O)OC(C)(C)C)c1ccc(Br)cc12,C59293445_decoy,WEE1,Decoy,0.0,-5.19017,-4.47,-2.32,-3.54056921847035
N#CC1=C(N)OC2=NN=C(c3ccc(Cl)c(Cl)c3)[C@@H]2[C@@H]1c1cc2c(cc1Br)OCO2,C00718461_decoy,WEE1,Decoy,0.0,-6.03357,-3.76,-3.03,-2.3869488043427687
CC(=O)C1=C(C)NC(SCC(=O)/N=c2\[nH]c3ccccc3s2)=C(C#N)[C@@H]1c1ccccc1[N+](=O)[O-],C09312774_decoy,WEE1,Decoy,0.0,-8.55153,-10.54,-4.61,-7.613752713203369
O=C([C@H]1Nc2cc(C(F)(F)F)ccc2S(=O)(=O)N1)N1CCN(c2cccc(C(F)(F)F)c2)CC1,C64775297_decoy,WEE1,Decoy,0.0,-7.93786,-9.5,-1.84,-8.340876529989156
C[C@@H](NC(=O)c1cc(NC(=O)Nc2cccc(F)c2)ccc1N(C)C)c1ccccc1,C04366898_decoy,WEE1,Decoy,0.0,-7.5405,-10.03,-2.01,-8.342905375308717
Nc1c(C(=O)NCc2cccs2)c2nc3ccccc3nc2n1CCC1=CCCCC1,C02349493_decoy,WEE1,Decoy,0.0,-9.37266,-9.62,-1.63,-9.446310513383192
N#Cc1c(NC(=O)CSc2nnc(N)s2)sc2c1CC[C@H](c1ccccc1)C2,C08416964_decoy,WEE1,Decoy,0.0,-9.12117,-8.59,0.01,-7.760036114289177
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/c3ccc4c(c3)OCO4)c2C(N)=O)C1,C00669049_decoy,WEE1,Decoy,0.0,-9.85671,-9.28,-0.75,-16.499376953261354
O=C(Nc1ccc(NC(=S)NC(=O)c2ccccc2F)cc1)c1cccc(Cl)c1,C00683819_decoy,WEE1,Decoy,0.0,-8.15682,-9.29,-2.07,-7.086479287584133
COc1cc(/C=N/NC(N)=O)cc(Br)c1OCc1cccc2ccccc12,C09678742_decoy,WEE1,Decoy,0.0,-9.19777,-8.74,-1.08,-8.21750621945455
COc1ccc(Br)cc1C(=O)NC(=S)NNC(=O)c1ccc(C)cc1,C09696099_decoy,WEE1,Decoy,0.0,-9.51859,-9.12,-1.99,-9.569595342239529
Nn1c(SCC(=O)Nc2cccc(C(F)(F)F)c2)nnc1-c1ccc(Cl)cc1,C10186304_decoy,WEE1,Decoy,0.0,-7.99303,-8.88,-0.61,-7.599083731509773
Oc1c(Br)cc(C=NNC(=S)NC[C@@H]2CCCO2)cc1Br,C12367990_decoy,WEE1,Decoy,0.0,-9.40403,-7.32,-0.92,-8.53492051902723
O=C(Nc1ccc2[nH]ccc2c1)C1CCC(CNS(=O)(=O)c2ccc(F)cc2)CC1,C12408395_decoy,WEE1,Decoy,0.0,-8.99945,-2.32,-1.85,-3.8376726409472273
C/C(=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O)[C@@H](O)C[C@@]1(C)[C@H](C)CCC(=O)[C@@H]1C,C13432980_decoy,WEE1,Decoy,0.0,-9.64727,-7.73,-3.33,-4.9248232117008
CCNC(=O)c1ccc(NC(=S)NC(=O)c2ccc(C)c(I)c2)cc1,C13631650_decoy,WEE1,Decoy,0.0,-9.27002,-8.12,-0.91,-11.762668408146062
O=C(/C=C/c1cccs1)NC(=S)NNC(=O)c1ccccc1I,C13979376_decoy,WEE1,Decoy,0.0,-8.34991,-6.29,-1.37,-7.720811230919829
CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2,C14457445_decoy,WEE1,Decoy,0.0,-10.0922,-8.55,-1.77,-7.896764132138898
CCCOc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1Br,C14646994_decoy,WEE1,Decoy,0.0,-9.80552,-8.73,-0.42,-8.737973930397231
C/C(=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O)[C@H](O)C[C@@]1(C)[C@H](C)CCC(=O)[C@H]1C,C14957950_decoy,WEE1,Decoy,0.0,-8.87108,-8.72,-1.22,-8.897979535397239
Cn1nc(C(=O)NCc2ccccc2F)c2c1CC[C@H](NCc1cc3ccccc3[nH]1)C2,C14532681_decoy,WEE1,Decoy,0.0,-8.00437,-6.45,-3.47,-5.479160205252165
Cc1ccc(CC(=O)Nc2sc3c(c2C(N)=O)CCN(Cc2ccccc2)C3)c(C)c1,C20574243_decoy,WEE1,Decoy,0.0,-9.61673,-9.75,-1.33,-8.60434517927006
CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(O)c(OC)c1)N2,C20693524_decoy,WEE1,Decoy,0.0,-9.4934,-8.59,-1.86,-8.713436831008224
CC1=Nc2sc3c(c2[C@@H](SCC(=O)Nc2ccc(Br)cc2)N1N)CCCC3,C26961100_decoy,WEE1,Decoy,0.0,-9.6609,-7.49,-2.08,-7.767951952570172
CC(=O)Nc1ccc(NC(=O)c2cccc(NC(=O)C(C)(C)C)c2)c(C(F)(F)F)c1,C28617190_decoy,WEE1,Decoy,0.0,-8.27141,-8.97,-0.93,-8.712833996183047
CC[C@@H](C(=O)Nc1sc(C)c(C)c1C(N)=O)n1c(=O)cc(C)c2cc(C)cc(C)c21,C32527458_decoy,WEE1,Decoy,0.0,-6.96258,-6.44,-1.35,-4.533923055159381
Cc1cc(C)c2c(c1)c(C)cc(=O)n2CCC(=O)Nc1sc2c(c1C(N)=O)CCCC2,C32527496_decoy,WEE1,Decoy,0.0,-9.1607,-8.61,-3.52,-7.558934572040719
NC(=O)[C@H]1C[C@H](O)CN1c1nc(CSc2ccc(Cl)cc2)nc2sc3c(c12)CCC3,C33010948_decoy,WEE1,Decoy,0.0,-10.434,-8.85,-0.81,-9.156527083501627
O=C(Nc1ccccc1)c1ccc([C@@H]2Nc3cc(C(F)(F)F)ccc3S(=O)(=O)N2)cc1,C33063317_decoy,WEE1,Decoy,0.0,-8.17465,-9.94,-4.2,-8.567232302104447
O=C(NCc1ccc(F)cc1)c1ccc([C@@H]2Nc3cc(C(F)(F)F)ccc3S(=O)(=O)N2)cc1,C33063333_decoy,WEE1,Decoy,0.0,-8.71195,-9.63,-2.91,-6.849581251170397
Cc1ccc([C@]2(O)NC(=O)N[C@@H](c3ccc(C(C)C)cc3)[C@@H]2C(=O)C(F)(F)F)cc1,C35023524_decoy,WEE1,Decoy,0.0,-6.86884,-5.11,-4.03,-4.614439583703059
C=C1[C@@H](O)[C@@H]2/C=C/C[C@H](C)CCC[C@H](O)/C=C\C(=O)O[C@@]23C(=O)N[C@@H](Cc2ccccc2)[C@H]3[C@H]1C,C35024465_decoy,WEE1,Decoy,0.0,-6.45264,-6.27,-1.55,-3.1046412812112987
C[C@@]1(O)CC(=O)[C@@H](C(=O)Nc2ccccc2)[C@H](c2ccc(F)cc2)[C@@H]1C(=O)Nc1ccccc1,C35982201_decoy,WEE1,Decoy,0.0,-7.46043,-5.8,-4.56,-4.955349132782741
O=C1N[C@@H](c2ccc(Br)cc2)[C@@H](C(=O)c2ccc(Cl)cc2)[C@](O)(C(F)(F)F)N1,C36056505_decoy,WEE1,Decoy,0.0,-7.4305,-4.79,-1.4,-5.760204749139688
Cc1cc(S(N)(=O)=O)cc(NC(=O)CN2CCc3sccc3[C@H]2c2cccs2)c1C,C12914489_decoy,WEE1,Decoy,0.0,-11.6382,-7.58,-1.7,-9.331937512647592
CCC(=O)Nc1cc(NC(=S)NC(=O)c2ccc(C)c(I)c2)ccc1C,C36568104_decoy,WEE1,Decoy,0.0,-7.9998,-7.03,-3.56,-6.209367857272091
C[C@H](NC(=O)c1ccccc1N1CCC(NC(=O)NC(C)(C)C)CC1)c1ccccc1,C37525355_decoy,WEE1,Decoy,0.0,-7.72428,-6.78,-2.73,-6.358022342875676
CC(=O)Nc1ccc(N[C@@H]2CCCC[C@H]2NS(=O)(=O)c2ccc(Cl)cc2)cc1,C05976283_decoy,WEE1,Decoy,0.0,-6.61526,-8.87,-2.72,-6.516717858736389
CC(C)c1ccc(NC(=O)C2CCC(CNC(=O)[C@@H]3Cc4ccccc4CN3)CC2)cc1,C35485526_decoy,WEE1,Decoy,0.0,-9.24859,-8.26,-3.09,-7.230567673084322
CC1=C(C(N)=O)[C@@H](c2ccc(Br)cc2)N2NC(c3ccc(Cl)cc3)=NC2=N1,C00940659_decoy,WEE1,Decoy,0.0,-9.00628,-5.29,-1.45,-4.554587723452621
Oc1c(Br)cc(/C=N/NC(=S)NC[C@H]2CCCO2)cc1Br,C13657884_decoy,WEE1,Decoy,0.0,-9.85272,-6.4,-0.61,-7.888306315301247
Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)c(C)c1,C39561146_decoy,WEE1,Decoy,0.0,-9.05639,-7.06,-3.34,-7.499688879321238
CC(C)Oc1ccc([C@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2cccs2)cc1,C39850363_decoy,WEE1,Decoy,0.0,-7.01349,-5.05,-2.5,-3.8506574589855007
Cc1c(C(N)=O)cc(-c2csc(Nc3cccc(C(F)(F)F)c3)n2)n1C1CCCC1,C44161632_decoy,WEE1,Decoy,0.0,-8.90292,-9.23,-0.38,-14.613461467962903
Cc1ccccc1Nc1nc(-c2cc(C(N)=O)c(C)n2Cc2ccc(F)cc2F)cs1,C44162062_decoy,WEE1,Decoy,0.0,-8.99365,-5.69,-2.86,-5.343539192257426
[H]/N=C1\S/C(=C\c2c3ccccc3cc3ccccc23)C(=O)N1c1ccc(S(N)(=O)=O)cc1,C15053817_decoy,WEE1,Decoy,0.0,-7.65034,-9.2,-3.34,-7.331243773886795
Nc1cc(S(=O)(=O)[N-]c2c(Br)cc(Br)cc2Br)cc[nH+]1,C50650660_decoy,WEE1,Decoy,0.0,-9.88156,-7.39,-0.78,-8.938874317258442
C[C@H](NC(=O)NCC(=O)Nc1ccc(F)c(F)c1F)c1cccc(Br)c1,C58686634_decoy,WEE1,Decoy,0.0,-7.18206,-7.56,-1.63,-5.947139395591205
Cc1cc(SCC(=O)Nc2ccccc2NC(=O)NC(C)C)c(C)cc1Br,C59017780_decoy,WEE1,Decoy,0.0,-7.94882,-8.32,-3.82,-7.195530138754072
O=C(Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F)N[C@@H]1CCOc2ccccc21,C59054340_decoy,WEE1,Decoy,0.0,-8.02943,-10.15,-5.25,-7.711162602831198
N#Cc1ccccc1COc1ccc(/C=N/NC(N)=S)cc1I,C59166666_decoy,WEE1,Decoy,0.0,-8.69505,-7.06,-1.46,-7.412760885789405
CC1=C(C(=O)N/N=C/c2ccc(F)cc2)[C@@H](c2ccc(Br)cc2)NC(=S)N1,C59384852_decoy,WEE1,Decoy,0.0,-9.75319,-8.8,-3.49,-12.162614429187265
CC[C@H]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(I)c(O)c(OC)c2)N3)C1,C15945400_decoy,WEE1,Decoy,0.0,-11.184,-8.74,-0.35,-8.370010392881364
CCCNC(=O)c1ccc(NC(=O)NC2(c3ccc(Br)cc3)CCC2)cc1,C65594073_decoy,WEE1,Decoy,0.0,-7.74908,-8.7,-1.78,-7.115546175235064
O=C(COc1ccc(Br)cc1Br)NNC(=O)c1cc2ccccc2o1,C00941175_decoy,WEE1,Decoy,0.0,-7.868,-6.98,-1.12,-6.372290824974589
Cc1ccc(/C=C/C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CCCC3)cc1,C06038236_decoy,WEE1,Decoy,0.0,-9.78127,-9.74,-0.62,-10.20130501025909
Cc1nc2sc3c(c2c(=O)n1NC(=S)NC(=O)C12CC4CC(CC(C4)C1)C2)CCCC3,C09090245_decoy,WEE1,Decoy,0.0,-11.5044,-8.56,-1.9,-9.886990039021429
Cc1ccc([C@H]2Nn3c(C)nnc3S[C@H]2C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1,C09237408_decoy,WEE1,Decoy,0.0,-7.42125,-5.81,-2.05,-4.426399576171309
CCCc1nnc2n1N[C@H](c1ccc(F)cc1)[C@H](C(=O)Nc1ccccc1C(F)(F)F)S2,C09239229_decoy,WEE1,Decoy,0.0,-7.66669,-5.44,-3.41,-5.9445142002153
COC(=O)NC(=O)c1c(NC(=O)C(c2ccccc2)c2ccccc2)sc2c1CC[C@H](C)C2,C09298121_decoy,WEE1,Decoy,0.0,-10.2779,-9.16,-3.23,-10.004764445343538
COC(=O)NC(=O)c1c(NC(=O)c2ccc(Br)s2)sc2c1CCCCC2,C09298397_decoy,WEE1,Decoy,0.0,-9.652,-8.8,-2.3,-11.639441481239777
N#Cc1c(NC(=O)c2cnn3c2N[C@@H](c2cccs2)C[C@H]3C(F)(F)F)sc2c1CCC2,C09410762_decoy,WEE1,Decoy,0.0,-9.67953,-8.8,-1.23,-8.08815522859724
O=C(Nc1nccs1)C1CCC(CNS(=O)(=O)c2ccc(Br)s2)CC1,C09559537_decoy,WEE1,Decoy,0.0,-10.7381,-8.84,-2.15,-9.018808683578468
O=C(Nc1ccc(-c2ccccc2)cc1)c1ccc(NC2=N[C@H]3CS(=O)(=O)C[C@H]3S2)cc1,C09530117_decoy,WEE1,Decoy,0.0,-7.86774,-7.64,-1.93,-5.937451329968327
CC(=O)Nc1ccc(NC(=O)CSc2ccc(-c3ccc(Br)cc3)nn2)cc1,C10453146_decoy,WEE1,Decoy,0.0,-9.21384,-5.76,-3.46,-6.162682029117063
O=C(CSc1nnc(NC(=O)C23CC4CC(CC(C4)C2)C3)s1)Nc1cccc(Cl)c1,C12180488_decoy,WEE1,Decoy,0.0,-9.56077,-8.49,-1.28,-7.687904274770647
N#C[C@@]1(C(N)=O)[C@@H](c2ccncc2)[C@@H](C(=O)c2ccc(Cl)cc2)N2c3ccc(F)cc3C=C[C@@H]21,C12428979_decoy,WEE1,Decoy,0.0,-8.06052,-5.54,-3.02,-5.223086219762621
CCC1(CC)NC(=O)N(CC(=O)Nc2c(Br)cc(C)cc2Br)C1=O,C13137999_decoy,WEE1,Decoy,0.0,-7.78464,-6.88,-1.89,-7.524506356598819
O=C(Nc1ccc(Br)cc1)Nc1ccc2c(c1)N(S(=O)(=O)c1ccccc1)CC2,C13356065_decoy,WEE1,Decoy,0.0,-8.33082,-9.88,-2.38,-8.331566612020332
C#C[C@@]1(O)CC[C@@H]2[C@H]3CCC4=C/C(=N\OCC(=O)NCc5cccnc5)CC[C@]4(C)[C@@H]3CC[C@@]21C,C08740554_decoy,WEE1,Decoy,0.0,-9.74106,-9.53,-2.87,-7.42486372729478
N#C[C@@]1(C(N)=O)[C@@H]2C=Cc3cc(F)ccc3N2[C@@H](C(=O)c2ccc(Cl)cc2)[C@@H]1c1ccncc1,C15023963_decoy,WEE1,Decoy,0.0,-8.5545,-5.44,-1.79,-5.649444273233906
Cc1cc(C(=O)Nc2ccc(C)c(S(=O)(=O)Nc3ccc(Br)cc3)c2)c(C)o1,C15666033_decoy,WEE1,Decoy,0.0,-8.53437,-9.49,-1.7,-10.133575177853372
C[C@@H]1CCc2c(sc(NC(=O)c3cccc(NS(=O)(=O)c4ccc(F)cc4)c3)c2C#N)C1,C20570474_decoy,WEE1,Decoy,0.0,-8.49818,-5.67,-2.96,-4.847416455721655
O=S(=O)(Nc1ccc(NS(=O)(=O)c2cc(F)ccc2F)cc1)c1ccc(F)c(F)c1,C20628795_decoy,WEE1,Decoy,0.0,-8.30775,-8.84,-2.83,-8.176569685865267
O=C([O-])[C@H](c1c[nH]c2ccc(Br)cc12)[NH+]1CCC(c2noc3cc(F)ccc23)CC1,C20731083_decoy,WEE1,Decoy,0.0,-6.31507,-8.96,-1.73,-6.689207216031942
O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)NNC(=O)c1ccc(F)cc1,C21120426_decoy,WEE1,Decoy,0.0,-8.39541,-9.02,-2.52,-8.363137029198793
C/C(=N/NS(=O)(=O)c1ccc(Br)cc1)c1ccc(NC(=O)C(F)(F)F)cc1,C22573063_decoy,WEE1,Decoy,0.0,-7.46124,-7.93,-1.65,-6.905568793257481
CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)C3CCN(C(=O)c4cccs4)CC3)cc2C1,C23296591_decoy,WEE1,Decoy,0.0,-10.7938,-9.46,-1.86,-9.241972881721608
O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(SCc2cn3ccccc3n2)cc1,C24358570_decoy,WEE1,Decoy,0.0,-9.6545,-9.7,-2.56,-7.606411004244141
Cc1ccc(N2C(=O)C[C@H](C(=O)Nc3ccc(C(=O)NC4CC4)cc3)[C@H]2c2cccs2)cc1,C24890149_decoy,WEE1,Decoy,0.0,-8.68212,-5.93,-2.77,-5.549126112228136
CC1=C(C(=O)Nc2cccc(C)n2)[C@H](c2ccc(Cl)cc2)C2=C(C[C@@H](c3ccco3)CC2=O)N1,C26456482_decoy,WEE1,Decoy,0.0,-7.39076,-5.12,-2.17,-4.78019305229024
O=C(N[C@@H]1CCC[C@@H]1NC(=O)c1ccc(-n2ccccc2=O)cc1F)c1ccc(Cl)s1,C28822935_decoy,WEE1,Decoy,0.0,-9.33128,-6.44,-2.45,-6.48617612596164
CCC(=O)Nc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C(=O)c3cccc4ccccc34)C2)cc1,C31827737_decoy,WEE1,Decoy,0.0,-7.96912,-9.99,-4.19,-7.327980093010631
O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc(N2CCCC2)c(C(=O)N2CCCCC2)c1,C00747584_decoy,WEE1,Decoy,0.0,-8.22542,-9.91,-2.66,-8.498384672427315
Cc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@](C(=O)[O-])(c1ccccc1)[NH2+][C@H]2c1ccc(Cl)s1,C35403761_decoy,WEE1,Decoy,0.0,-8.12162,-5.19,-3.66,-4.867055165287215
Cc1ccccc1C(=O)N[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCN(C(=O)c2ccccc2F)C1,C35955602_decoy,WEE1,Decoy,0.0,-8.02445,-10.61,-2.48,-8.597413173307402
C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)NC(=O)NC1CCCCC1,C36796621_decoy,WEE1,Decoy,0.0,-9.5503,-7.04,-2.15,-7.165173363452944
C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1Cl,C38651047_decoy,WEE1,Decoy,0.0,-7.76007,-8.98,-1.17,-7.035754186951746
C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(Cl)c1,C38651211_decoy,WEE1,Decoy,0.0,-8.45653,-10.22,-1.82,-8.598392883399262
COC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)Nc2ccc(Br)cc2)cc1,C39894589_decoy,WEE1,Decoy,0.0,-8.89141,-5.17,-3.64,-5.072623198579163
CCCc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2,C40569371_decoy,WEE1,Decoy,0.0,-8.65714,-4.75,-1.48,-4.846023885402169
C#C[C@]1(O)CC[C@@H]2[C@H]3CCC4=C/C(=N\OCC(=O)NCc5ccco5)CC[C@@]4(C)[C@@H]3CC[C@]21C,C43741555_decoy,WEE1,Decoy,0.0,-10.4796,-8.54,-1.53,-8.39372849817917
Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2,C46901025_decoy,WEE1,Decoy,0.0,-9.24237,-9.69,-2.05,-8.485550372238873
Cc1cc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1,C58912918_decoy,WEE1,Decoy,0.0,-8.39258,-8.96,-1.49,-7.712704567557951
O=C(Nc1ccccc1N1CCCCC1)c1cccc(NC(=O)c2ccc(Br)o2)c1,C59271865_decoy,WEE1,Decoy,0.0,-9.21735,-10.11,-4.2,-9.780797929133172
O=C(NC[C@@H]1CCCO1)C1=C(Br)C2=N[C@@H](c3ccccc3)C[C@H](C(F)(F)F)N2N1,C13387839_decoy,WEE1,Decoy,0.0,-9.06065,-6.4,-1.07,-5.742923052027194
C[C@H](NC(=O)c1ccc(N2CCCCC2=O)cc1)c1ccc(NC(=O)c2ccc(F)cc2)cc1,C59812819_decoy,WEE1,Decoy,0.0,-7.46907,-2.6,-2.65,-3.385784134107397
O=C(NCCNc1ncc(Cl)cc1Cl)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2,C59895409_decoy,WEE1,Decoy,0.0,-8.93938,-7.59,-2.31,-9.380219047100882
CCC1CCC2(CC1)NC(=O)N(CC(=O)NC1(c3cccc(Br)c3)CCC1)C2=O,C59919807_decoy,WEE1,Decoy,0.0,-8.92462,-9.72,-2.67,-9.426268432115585
O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1NC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1,C60334522_decoy,WEE1,Decoy,0.0,-7.9909,-10.81,-2.36,-9.414948015852143
O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1NC(=O)[C@H]1CCCN(C(=O)C2CC2)C1,C60334523_decoy,WEE1,Decoy,0.0,-8.69344,-9.9,-1.53,-9.12381339002136
N/C(=N\C(=O)c1ccccc1)[C@H]1C(=O)N(c2ccccc2)N=C1CSc1ccc(Cl)cc1,C09311000_decoy,WEE1,Decoy,0.0,-8.49484,-8.67,-2.73,-7.952989522299056
CC1=Nc2nc(SCc3ccccc3F)nn2[C@H](c2cccc(Br)c2)[C@H]1C(N)=O,C02458746_decoy,WEE1,Decoy,0.0,-10.0801,-9.67,-1.73,-9.879095760603862
Nc1c(-c2nnc(SCc3ccc(F)cc3F)n2C[C@H]2CCCO2)sc2ncccc12,C64794618_decoy,WEE1,Decoy,0.0,-8.9386,-8.89,-2.05,-7.858902846103202
C[C@H](C(=O)N1CCSCC1)[C@@H]1CC[C@]2(C)Cc3sc(NC(=O)C4CC4)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840771_decoy,WEE1,Decoy,0.0,-9.32481,-5.64,-2.8,-5.366932209502375
Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(I)cc3)cc2)o1,C03357084_decoy,WEE1,Decoy,0.0,-8.65989,-8.11,-4.11,-6.783265509388922
CCOc1ccc2c(c1)-c1c(ssc1=S)C(C)(C)N2C(=O)CSc1nnc(N)s1,C02962134_decoy,WEE1,Decoy,0.0,-10.0549,-7.22,-2.1,-8.516053661445758
COC(=O)C1=C(N)n2c(s/c(=C\c3ccc(Cl)cc3)c2=O)=C(C#N)[C@@H]1c1ccc(Cl)cc1,C08618075_decoy,WEE1,Decoy,0.0,-8.18661,-8.14,-0.17,-5.965289427685832
O=C(NC(=S)Nc1cc(-c2nc3ncccc3o2)ccc1Cl)c1ccc(Cl)c(Cl)c1,C08835240_decoy,WEE1,Decoy,0.0,-9.25421,-9.33,-1.93,-8.401586294159802
COc1ccc(Cl)cc1NC(=O)[C@@H]1CCCc2sc(NC(=O)c3ccc(Cl)cc3)nc21,C09073414_decoy,WEE1,Decoy,0.0,-10.0098,-6.15,-5.58,-6.781467165557684
Cc1nnc2n1N[C@H](c1ccc(F)cc1)[C@H](C(=O)Nc1ccc(Br)cc1Cl)S2,C09237616_decoy,WEE1,Decoy,0.0,-8.22291,-4.63,-3.61,-3.544712750192645
O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c[nH]c(=O)n(-c2ccc(Cl)cc2)c1=O,C09346803_decoy,WEE1,Decoy,0.0,-6.68801,-8.8,-1.87,-6.871458363344699
O=c1[nH]c(CSc2nnc(NC3CC3)s2)nc2c(Br)cc(Br)cc12,C09949870_decoy,WEE1,Decoy,0.0,-9.47348,-4.75,-1.77,-5.209253667598944
CC(C)N1C[C@@H](C(=O)Nc2ccc(C(=O)Nc3ccc(I)cc3)cc2)CC1=O,C11097523_decoy,WEE1,Decoy,0.0,-8.19525,-5.94,-1.56,-5.056091951200446
Nc1ccc(-n2nnc(S(=O)(=O)c3cccc(C(F)(F)F)c3)c2-c2ccc(Cl)cc2)cc1,C11730794_decoy,WEE1,Decoy,0.0,-7.3576,-9.6,-3.07,-7.218148872732262
CC(C)Sc1nnc(N2C(N)=C(C#N)[C@H](c3ccc(C(C)(C)C)s3)C3=C2CCCC3=O)s1,C12401682_decoy,WEE1,Decoy,0.0,-9.35527,-4.6,-3.02,-5.125232136912447
COc1ccc(C(=O)NNC(=O)COc2c(C)cc(Br)cc2C)cc1Br,C12490061_decoy,WEE1,Decoy,0.0,-9.21716,-8.57,-2.99,-7.796168261109201
N#CC1=C(N)N(c2ccc(Br)cc2F)C2=C(C(=O)CCC2)[C@@H]1c1ccc2c(c1)OCO2,C00995817_decoy,WEE1,Decoy,0.0,-7.42683,-5.47,-1.73,-4.449267551527553
COc1cc([C@H]2Nc3c(C(=O)Nc4ccc(C)c(C)c4)cccc3[C@H]3C=CC[C@@H]32)ccc1OC(C)=O,C14468865_decoy,WEE1,Decoy,0.0,-9.66457,-10.47,-1.51,-9.56919730746976
CC1(C)Nc2ccccc2-c2c1sn(-c1ccc(S(=O)(=O)Nc3nccs3)cc1)c2=S,C15087238_decoy,WEE1,Decoy,0.0,-10.6423,-5.93,-2.67,-6.157039099965273
CC1(C)CC(=O)C2=C(C1)N(c1cccc(C(F)(F)F)c1)C(N)=C(C#N)[C@H]2c1ccc2c(c1)OCO2,C01436334_decoy,WEE1,Decoy,0.0,-5.50146,-5.98,-0.62,-4.340887058233857
Cc1ccc(NC(=O)c2c(C)oc(C)c2C)cc1S(=O)(=O)Nc1ccc(Br)cc1,C15666039_decoy,WEE1,Decoy,0.0,-8.10626,-9.64,-1.94,-8.311160310974895
Cc1ccc(S(=O)(=O)N2C(N)=C(C#N)[C@H](c3ccc(Cl)cc3)[C@H]2C(=O)c2ccccc2)cc1,C20086028_decoy,WEE1,Decoy,0.0,-7.44611,-6.25,-3.15,-4.416552995692981
COc1ccc(C(=O)Nc2ccccc2Br)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C,C22405238_decoy,WEE1,Decoy,0.0,-9.49202,-9.2,-2.26,-9.38650506192449
COc1ccc(C(=O)Nc2ccccc2Br)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C,C22405240_decoy,WEE1,Decoy,0.0,-9.94548,-9.52,-1.39,-11.8724633284963
C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)COC(=O)c1cc(Br)c(Br)s1,C23633987_decoy,WEE1,Decoy,0.0,-9.88775,-7.79,-0.82,-7.80904039997639
CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)Nc1cc2c(cc1Br)OCCO2,C25922484_decoy,WEE1,Decoy,0.0,-9.43916,-6.67,-4.05,-7.647487662663182
Cc1cc(NC(=O)c2cc3c(s2)CC[C@@H](C)C3)ccc1NC(=O)c1cccc(S(C)(=O)=O)c1,C26553641_decoy,WEE1,Decoy,0.0,-9.18629,-9.41,-1.2,-7.842349538152771
Cc1ccsc1C(=O)Nc1cc(Cl)c(NC(=O)c2ccc(S(C)(=O)=O)cc2)c(Cl)c1,C26884590_decoy,WEE1,Decoy,0.0,-10.3858,-5.44,-2.57,-5.668252283220704
[H]/N=C(/N/N=C(\C)c1ccc(Br)s1)S[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O,C12378763_decoy,WEE1,Decoy,0.0,-11.3478,-7.85,-1.44,-10.121204031104975
O=C(Nc1ccc(N2CCN(C(=O)c3ccc4ccccc4c3)CC2)cc1)Nc1ccc(F)cc1F,C00739418_decoy,WEE1,Decoy,0.0,-8.96664,-9.45,-4.04,-8.405114760904357
O=C(N[C@@H]1CCCCNC1=O)c1cn2c(n1)CC[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C2,C34899120_decoy,WEE1,Decoy,0.0,-8.58314,-8.41,-3.92,-7.718111862140353
O=C(N[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCN(C(=O)C23CC4CC(CC(C4)C2)C3)C1)c1ccccc1,C34899472_decoy,WEE1,Decoy,0.0,-8.84045,-6.65,-5.5,-5.258552622655768
C=C1[C@@H](O)[C@@H]2/C=C/C[C@H](C)CCCC(=O)/C=C\C(=O)O[C@@]23C(=O)N[C@@H](Cc2ccccc2)[C@H]3[C@H]1C,C35024451_decoy,WEE1,Decoy,0.0,-8.04201,-5.66,-3.15,-4.241935170313741
N#CC1=C(N)OC2=C(CN(C(=O)OCc3ccccc3)C/C2=C\c2cccs2)[C@@H]1c1cccs1,C35300361_decoy,WEE1,Decoy,0.0,-11.117,-5.26,-1.79,-6.664735171847038
COc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc(Br)c1OC1CCCC1,C36612696_decoy,WEE1,Decoy,0.0,-9.54653,-9.5,-0.66,-9.434523613266748
Cc1cccc(-n2nc(C(C)(C)C)c3c2N(CC(N)=O)C(=O)CS[C@@H]3c2ccc(F)cc2F)c1,C37263959_decoy,WEE1,Decoy,0.0,-6.38197,-4.53,-1.33,-3.858524572645528
C[C@@H]1CCc2c(sc(NC(=O)Cc3ccc(Cl)cc3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C38615384_decoy,WEE1,Decoy,0.0,-10.3551,-8.92,-1.27,-10.76779685997994
C/C1=C/C[C@@H](/C(C)=C/c2csc(C)n2)OC(=O)C[C@@H](O)C(C)(C)C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCC1,C38664691_decoy,WEE1,Decoy,0.0,-9.50321,-5.37,-4.31,-4.006557880562298
C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1Br,C38678739_decoy,WEE1,Decoy,0.0,-9.50749,-9.68,-2.12,-8.339946429696278
Cc1cc(C(F)(F)F)nc2c1[C@@H]1N[C@@H]([C@@H]3C=NN=C3c3ccc(Br)cc3)NC(=O)[C@@H]1S2,C39237607_decoy,WEE1,Decoy,0.0,-8.24708,-7.68,-0.56,-6.297090024337119
CCCSc1nnc(N2C(N)=C(C#N)[C@@H](c3ccccc3Cl)C3=C2CC(C)(C)CC3=O)s1,C39425991_decoy,WEE1,Decoy,0.0,-8.93026,-4.94,-2.2,-5.526162938111839
CC(C)Sc1nnc(N2C(N)=C(C#N)[C@@H](c3cccc(Cl)c3)C3=C2CC(C)(C)CC3=O)s1,C39425997_decoy,WEE1,Decoy,0.0,-9.66037,-4.58,-2.41,-4.870852035650119
CSc1nnc(N2C(N)=C(C#N)[C@H](c3c(F)cccc3Cl)C3=C2CC(C)(C)CC3=O)s1,C39426043_decoy,WEE1,Decoy,0.0,-9.37422,-4.35,-1.6,-4.930820567276918
CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)Nc1cccc(I)c1)C2=O,C36708774_decoy,WEE1,Decoy,0.0,-8.53484,-8.67,-2.63,-9.6964697274916
Cc1cc(C)c(NC(=O)CSc2nnc(NC(=O)c3cc(Cl)ccc3Cl)s2)c(C)c1,C39723554_decoy,WEE1,Decoy,0.0,-9.83299,-9.08,-2.52,-8.100412290670528
Nc1c(Oc2ccc(Br)c3cccnc23)ncnc1Sc1cccc2cccnc12,C40796919_decoy,WEE1,Decoy,0.0,-9.09964,-9.07,-0.74,-7.472400008061181
O=C(Nc1ccc(F)cc1)N1CCC(CNS(=O)(=O)c2ccc(Br)s2)CC1,C43962385_decoy,WEE1,Decoy,0.0,-8.97667,-8.23,-2.41,-7.061279941108296
C=C1[C@@H](C)[C@@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]23OC(=O)/C=C\C(=O)CCC[C@@H](C)C/C=C/[C@H]3[C@@H]1O,C44830936_decoy,WEE1,Decoy,0.0,-7.53334,-6.2,-3.82,-4.562461513031107
COc1ccc(-c2csc(NC(=S)NC(=O)c3cc4ccccc4o3)n2)cc1Br,C09345498_decoy,WEE1,Decoy,0.0,-10.5451,-8.27,-4.48,-8.731034152451464
Cc1cccc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@@H](c2ccc(Br)cc2)N3)n1,C00681693_decoy,WEE1,Decoy,0.0,-7.45481,-5.94,-4.13,-4.393025269561267
Cc1ccc(C(=O)N2CCN(c3ccc(NC(=S)NC(=O)c4cc(C)cc(C)c4)cc3)CC2)cc1,C22744656_decoy,WEE1,Decoy,0.0,-7.95514,-8.29,-3.09,-5.935878689818673
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1,C60248432_decoy,WEE1,Decoy,0.0,-9.05534,-8.36,-2.81,-7.126777133780466
Cc1ccc(C(=O)[C@H]2[C@@H]3CCCN3[C@@]3(C(=O)Nc4c(C)cc(C)cc43)[C@@]23C(=O)Nc2ccccc23)cc1,C15967917_decoy,WEE1,Decoy,0.0,-6.36087,-5.23,-2.31,-3.880486942323404
CC[C@@H]1CCc2c(sc(NC(=O)c3c(-c4ccccc4)noc3C)c2C(N)=O)C1,C00995183_decoy,WEE1,Decoy,0.0,-8.63475,-8.56,-2.88,-10.391295266311232
C[C@@H]1CCc2sc(NC(=O)c3cccc(Oc4ccccc4)c3)c(C(N)=O)c2C1,C04177465_decoy,WEE1,Decoy,0.0,-9.67521,1.86,-0.53,-2.730007108147709
O=C(Nc1ccc(N2CCc3ccccc3C2)c(C(=O)NC2CC2)c1)Nc1ccccc1F,C00751323_decoy,WEE1,Decoy,0.0,-9.56915,-9.29,-1.37,-8.711771873401515
Cc1ccc(-c2nnc(S[C@H](C)C(=O)N[C@@H]3CCCc4ccccc43)n2N)cc1,C06557918_decoy,WEE1,Decoy,0.0,-8.59651,-7.0,-2.27,-6.469855749394856
Nc1c(C(=O)NC2CCCC2)c2nc3ccccc3nc2n1-c1ccc(Br)cc1,C02247497_decoy,WEE1,Decoy,0.0,-8.77478,-9.55,-0.02,-19.59069815002049
Nn1c(SCC(=O)Nc2ccccc2I)nnc1C1CCCCC1,C08984482_decoy,WEE1,Decoy,0.0,-9.33762,-8.08,-1.53,-7.674182289391073
Cc1cc(Br)ccc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1N,C09459701_decoy,WEE1,Decoy,0.0,-8.40915,-8.94,-0.68,-7.651556240650962
NC(=O)c1ccc(N2CCCC2)c(NC(=O)/C=C/c2ccccc2Br)c1,C09905121_decoy,WEE1,Decoy,0.0,-8.78307,-9.73,-1.85,-9.334245114557367
CCc1c(C)sc(NC(=O)c2ccc(OC)c(I)c2)c1C(N)=O,C10149126_decoy,WEE1,Decoy,0.0,-8.9886,-8.6,-1.49,-8.53823194033233
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3ccccc3)c2C(=O)N2CCC(C(N)=O)CC2)C1,C12381406_decoy,WEE1,Decoy,0.0,-9.15739,-10.08,-1.69,-9.6190436167377
NC(=O)c1c(NC(=O)c2ccc3c(c2)C[C@H](c2ccccc2)OC3=O)sc2c1CCCC2,C13096565_decoy,WEE1,Decoy,0.0,-8.81146,-9.54,-1.85,-7.593615400109655
O=C(NC(=S)NNC(=O)c1ccccc1I)c1ccccc1F,C14037595_decoy,WEE1,Decoy,0.0,-8.28902,-7.7,-2.19,-8.242611453534535
Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)C(=O)Nc3ccc(F)c(F)c3F)sc2n1,C14151899_decoy,WEE1,Decoy,0.0,-7.80512,-8.86,-0.46,-6.856643039548089
C=CCNS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc(Br)ccc1O)N2,C14461017_decoy,WEE1,Decoy,0.0,-8.6926,-6.35,-1.32,-4.846912272427397
Cc1c(C(=O)NC2CCC(O)CC2)sc2ncnc(N[C@@H](C)c3cccs3)c12,C14990849_decoy,WEE1,Decoy,0.0,-11.2291,-7.9,-1.01,-12.14253487901468
Cc1cc2c(c(-c3ccc(C(N)=O)cn3)c1)O[C@H](CNC(=O)C13CC4CC(CC(C4)C1)C3)C2,C14991264_decoy,WEE1,Decoy,0.0,-8.78673,-6.09,-2.02,-5.689294132436671
Nc1nc2n(n1)[C@H](c1ccc(C(F)(F)F)cc1)C1=C(C[C@@H](c3cccs3)CC1=O)N2,C18200657_decoy,WEE1,Decoy,0.0,-7.67129,-4.46,-2.68,-3.8641882319136265
C[C@H](Sc1ncc(-c2ccc(Br)cc2)[nH]1)C(=O)NC(=O)NC(C)(C)C,C18597318_decoy,WEE1,Decoy,0.0,-8.53002,-8.11,-3.33,-9.41606136984457
N#Cc1c(N)nc(SCC(=O)NC23CC4CC(CC(C4)C2)C3)c(C#N)c1-c1cccs1,C19852091_decoy,WEE1,Decoy,0.0,-9.82381,-8.0,-2.32,-7.361100537289233
C[C@@H](Sc1nc(N)c2c3c(sc2n1)CCCC3)C(=O)Nc1ccccc1C#N,C21246093_decoy,WEE1,Decoy,0.0,-8.92829,-8.37,-1.71,-7.546640508088847
NC(=O)c1c(NC(=O)c2ccc(Br)cc2)sc2c1CCN(Cc1ccccc1)C2,C23153778_decoy,WEE1,Decoy,0.0,-10.2224,-9.01,-1.07,-11.106657509875957
O=C(CNC(=O)c1ccc(Br)o1)NNc1c(Cl)cc(Cl)cc1Cl,C25381902_decoy,WEE1,Decoy,0.0,-9.52699,-7.34,-2.56,-12.167319030150514
NC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2csc(-c3ccc(F)cc3)n2)c1,C25611773_decoy,WEE1,Decoy,0.0,-9.53655,-9.46,-1.96,-13.558301393967088
C[C@]1(O)CC(=O)[C@@H](C(=O)Nc2ccccc2)[C@@H](c2cccs2)[C@@H]1C(=O)Nc1ccccc1,C28250035_decoy,WEE1,Decoy,0.0,-8.56315,-5.36,-3.38,-5.272095945701166
COc1ccc(C(=O)[C@@H]2[C@@H](c3ccc(C#N)cc3)NC(=S)N[C@@]2(O)C(F)(F)F)cc1,C28467098_decoy,WEE1,Decoy,0.0,-8.20453,-5.05,-1.58,-5.77970265055324
Cc1c(C(=O)NNC(=O)N[C@H](C)c2cccc(Br)c2)oc2ccccc12,C32795224_decoy,WEE1,Decoy,0.0,-8.26568,-9.72,-1.84,-8.152777447137224
O=C(Nc1ccccc1)Nc1cc(NC(=O)c2ccc(F)cc2)ccc1N1CCCC1,C33009757_decoy,WEE1,Decoy,0.0,-8.57658,-9.35,-4.07,-8.240824675673032
NC(=O)[C@@H]1C[C@H](O)CN1c1nc(CSc2ccc(Cl)cc2)nc2sc3c(c12)CCC3,C33010946_decoy,WEE1,Decoy,0.0,-9.77414,-6.35,-1.56,-6.112288176787213
O=C(NCc1ccccc1)c1ccc([C@@H]2Nc3cc(C(F)(F)F)ccc3S(=O)(=O)N2)cc1,C33063341_decoy,WEE1,Decoy,0.0,-8.81812,-10.29,-2.37,-9.058418468297836
COc1ccc(C(=O)[C@H]2[C@H](c3ccc(F)cc3)NC(=S)N[C@]2(O)C(F)(F)F)cc1,C35023247_decoy,WEE1,Decoy,0.0,-6.96157,-5.13,-1.62,-4.635637176262753
CC1=C[C@H]2[C@]3(O)[C@H](C)[C@H](OC(=O)C(C)C)[C@@H]4[C@H]([C@H]3C=C(CO)C[C@@]2(O)C1=O)C4(C)C,C35024507_decoy,WEE1,Decoy,0.0,-7.37314,-4.44,-2.37,-4.3237646468120605
Cc1ccc(NC(=O)C2CCC(CNC(=O)[C@H]3Cc4ccccc4CN3)CC2)c(C)c1,C16021446_decoy,WEE1,Decoy,0.0,-8.37611,-9.98,-4.11,-5.003460404329028
CC1(C)CC(NC(=O)c2cccc(S(=O)(=O)[N-]c3cccc(Cl)c3)c2)CC(C)(C)[NH2+]1,C25330015_decoy,WEE1,Decoy,0.0,-8.9004,-10.47,-2.69,-9.574420522968154
C[C@H](Sc1nnc(C(F)(F)F)n1N)C(=O)Nc1cc(Cl)c(Cl)cc1Cl,C36640289_decoy,WEE1,Decoy,0.0,-9.20627,-8.31,-3.03,-8.648551688581623
NS(=O)(=O)c1ccc(NC(=O)CSC2c3ccccc3Oc3ccccc32)cc1,C40141825_decoy,WEE1,Decoy,0.0,-11.1629,-10.26,-1.02,-9.922793952565236
Nc1c(Nc2ccccc2C(F)(F)F)ncnc1N1CCN(c2ccccc2F)CC1,C40701864_decoy,WEE1,Decoy,0.0,-8.41816,-9.03,-1.77,-15.110534841515909
Cc1ccc(Br)cc1S(=O)(=O)Nc1ccc(NC(=O)NC2CC2)cc1,C45867792_decoy,WEE1,Decoy,0.0,-6.22555,-7.98,-1.58,-6.920088995713154
CC(C)CNC(=O)NNS(=O)(=O)c1cc(Br)ccc1Br,C49152305_decoy,WEE1,Decoy,0.0,-8.87375,-8.33,-3.36,-7.239540114030341
O=c1[nH]c2cc(Br)c(NCc3cc(Br)c(Br)o3)cc2[nH]1,C50360496_decoy,WEE1,Decoy,0.0,-7.42353,-7.61,-0.41,-6.277551935925158
COc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccc(Br)cc2)cc1,C09183613_decoy,WEE1,Decoy,0.0,-8.3464,-5.83,-2.81,-5.755986865977089
O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)c2ccc(F)cc2Br)cc1,C27856295_decoy,WEE1,Decoy,0.0,-8.06736,-8.81,-1.07,-10.634553169525546
O=C(NCc1ccco1)Nc1ccc(NC(=O)c2cccc(Br)c2)cc1,C27981922_decoy,WEE1,Decoy,0.0,-8.01505,-6.44,-1.25,-5.785889663223502
CC(C)(C)[C@@H]1CCc2sc(C(=O)Nc3cccc([C@]4(C)NC(=O)NC4=O)c3)cc2C1,C58983170_decoy,WEE1,Decoy,0.0,-8.93572,-9.24,-3.86,-7.42502582519648
Cc1c(F)cccc1NC(=O)CSc1nnc(-c2ccc(Br)cc2)n1N,C59045153_decoy,WEE1,Decoy,0.0,-9.33502,-8.19,-2.14,-12.05494796324753
C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(c4ccc(Cl)cc4)C3)c2C(N)=O)C1,C59317331_decoy,WEE1,Decoy,0.0,-10.5474,-9.1,-1.02,-8.122855206770158
CC1=C(C(=O)N/N=C/c2ccc(F)cc2)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1,C59384736_decoy,WEE1,Decoy,0.0,-8.75042,-5.41,-3.35,-5.608888271988905
Cc1n[nH]c2c1[C@H](c1ccccc1OCc1ccc(Br)cc1)C(C#N)=C(N)O2,C59447010_decoy,WEE1,Decoy,0.0,-7.15502,-8.33,-1.99,-7.207076606179375
Nn1c(SCC(=O)Nc2ccc(I)cc2)nnc1-c1ccc(F)cc1,C21092545_decoy,WEE1,Decoy,0.0,-8.49535,-9.06,-0.75,-7.494680941075638
Cc1nc(NC(=O)c2ccc(Cl)cc2)sc1[C@@H]1N[C@H](c2cccs2)NO1,C53620239_decoy,WEE1,Decoy,0.0,-8.85388,-9.07,-0.53,-8.429180961394712
CC[C@]1(C)CC2=C(CO1)S[C@H]1N=C(SCC(=O)Nc3ccc(Cl)cc3)N=C(N)[C@H]21,C66354559_decoy,WEE1,Decoy,0.0,-11.1038,-8.53,,99.0
Cc1cccc(NC(=O)c2ccccc2NC(=O)C(=O)N/N=C/c2c3ccccc3cc3ccccc23)c1,C02520403_decoy,WEE1,Decoy,0.0,-8.134,-9.53,-1.52,-7.614170199176686
Nc1c(C(=O)Nc2cccc3ccccc23)c2nc3ccccc3nc2n1-c1cccc(C(F)(F)F)c1,C02292353_decoy,WEE1,Decoy,0.0,-8.30009,-8.96,-1.62,-6.567664673234814
CC[C@@H](C)NC(=O)c1cc(NC(=O)Nc2ccccc2C(F)(F)F)ccc1N1CCc2ccccc2C1,C04190243_decoy,WEE1,Decoy,0.0,-8.79012,-7.66,-3.43,-7.578948634134159
CSc1ccc(NC(=O)Nc2ccc(N3CCC(C)CC3)c(C(=O)N[C@@H](C)c3ccccc3)c2)cc1,C04212966_decoy,WEE1,Decoy,0.0,-10.0924,-8.81,-1.9,-8.408904300860364
CC(C)(C)NNC(=O)/C(=C/c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1)NC(=O)c1ccccc1,C01628535_decoy,WEE1,Decoy,0.0,-9.89023,-6.69,-1.3,-8.090934306226101
Cc1ccccc1C(=O)N[C@H](NC(=S)Nc1sc2c(c1C#N)CCCC2)C(Cl)(Cl)Cl,C02905545_decoy,WEE1,Decoy,0.0,-9.18746,-8.66,-1.8,-8.3623247080124
Cc1ccccc1C(=O)N[C@@H](NC(=S)Nc1sc2c(c1C#N)CCCC2)C(Cl)(Cl)Cl,C02905546_decoy,WEE1,Decoy,0.0,-10.3069,-8.28,-1.65,-8.527686577840257
Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C(N)=O)CC[C@@H](C(C)(C)C)C4)c3ccccc3n2)cc1,C02085596_decoy,WEE1,Decoy,0.0,-10.1337,-10.15,-1.25,-8.40226712206178
COc1ccc(-c2cc(C(F)(F)F)c3c(N)c(C(=O)NC45CC6CC(CC(C6)C4)C5)sc3n2)cc1,C08451163_decoy,WEE1,Decoy,0.0,-9.64186,-10.01,-1.49,-16.86675567052362
O=C(/C=C/c1ccc(-c2ccc(Cl)cc2Cl)o1)NC(=S)Nc1ccc(-c2ccc(CO)o2)cc1,C08835235_decoy,WEE1,Decoy,0.0,-10.0671,-6.58,-2.85,-7.065318945428859
COc1cc2ccccc2cc1C(=O)NC(=S)Nc1ccc(NC(=O)c2cc3ccccc3o2)cc1,C08835686_decoy,WEE1,Decoy,0.0,-9.56833,-9.94,-1.98,-7.383599256837448
Cc1ccc(NC(=O)Nc2nc(CC(=O)Nc3ccc(-c4nc5ccc(C)cc5s4)cc3)cs2)cc1,C09784800_decoy,WEE1,Decoy,0.0,-9.16361,-6.11,-2.93,-5.416986228528894
COc1ccc(Nc2sc(C(=O)c3ccc(F)cc3)c(N)c2S(=O)(=O)c2ccc(C)cc2)cc1,C09673637_decoy,WEE1,Decoy,0.0,-8.11811,-8.95,-3.63,-7.858825827562242
Cc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccc(-c4ccccc4)cc3)cc2)c(C)c1,C12494332_decoy,WEE1,Decoy,0.0,-8.57339,-9.88,-1.85,-8.221550706162922
CCc1nc(N)sc1C(=O)N/N=C/c1ccc(N2N=C(c3ccccc3)C[C@H]2[C@H]2C=CC=CC2)cc1,C08800970_decoy,WEE1,Decoy,0.0,-11.1569,-6.68,-3.5,-6.598532272407526
Cc1ccc(NC(=O)COc2cc(C)c3c(c2)O[C@]2(C[C@H]3c3ccccc3)CC(C)(C)NC(=O)N2)cc1,C01421141_decoy,WEE1,Decoy,0.0,-9.12223,-11.03,-0.87,-9.065370990762869
NC(=O)c1c(NC(=O)c2cc(-c3ccc4c(c3)OCO4)nc3ccccc23)sc2c1CCCCCC2,C02772643_decoy,WEE1,Decoy,0.0,-8.58847,-11.14,-2.19,-7.73965752599786
CC[C@H](C)[C@@H](NC(=O)NC12CC3CC(CC(C3)C1)C2)C(=O)Nc1nnc(-c2ccc(Cl)cc2)s1,C16572283_decoy,WEE1,Decoy,0.0,-9.42445,-7.11,-1.68,-6.527215066811478
CC[C@@H](C)[C@@H](NC(=O)Nc1cccc(C)c1)C(=O)Nc1nnc(-c2ccc(Br)cc2)s1,C16572328_decoy,WEE1,Decoy,0.0,-9.63146,-8.31,-2.53,-9.142886426139809
CC[C@@H](C)[C@@H](NC(=O)Nc1cccc(F)c1)C(=O)Nc1nnc(-c2ccc(Br)cc2)s1,C16572344_decoy,WEE1,Decoy,0.0,-9.27025,-8.53,-1.3,-8.121967776509738
CC[C@H](C)[C@@H](NC(=O)Nc1ccc(C)cc1C)C(=O)Nc1nnc(-c2cccc(Br)c2)s1,C16573745_decoy,WEE1,Decoy,0.0,-8.9773,-6.55,-1.56,-5.731901898263208
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@H]1c1cccc(NC(=O)Nc2ccc(Br)cc2)c1,C16611032_decoy,WEE1,Decoy,0.0,-9.52675,-5.85,-3.52,-5.234579869758315
CCN1C(=S)N[C@H](c2ccc(NC(=O)Nc3ccc(F)c(F)c3)cc2)C(C(=O)OCC(C)C)=C1C,C16612542_decoy,WEE1,Decoy,0.0,-8.79721,-8.24,-3.78,-7.008971240684405
[H]/N=C(\N)S[C@@H]1CC[C@]2(C)C(=CC[C@H]3[C@H]2CC[C@]2(C)[C@@H](OS(=O)(=O)c4ccc(C)cc4)CC[C@@H]32)C1,C16923625_decoy,WEE1,Decoy,0.0,-8.6902,-5.98,-2.89,-5.355287766775568
Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@@H](c2cc(Cl)cc(Cl)c2O)N3)c1,C20701392_decoy,WEE1,Decoy,0.0,-10.4395,-10.16,-1.89,-8.112777728621296
Cc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2c(O)ccc4ccccc24)N3)c(C)c1,C20751735_decoy,WEE1,Decoy,0.0,-6.81128,-10.47,-4.12,-5.719324319719443
Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@@H](c2c(O)ccc4ccccc24)N3)c1,C20751744_decoy,WEE1,Decoy,0.0,-9.10117,-11.03,-2.52,-8.212562803791776
COc1ccccc1Nc1sc(C(=O)c2ccc(Cl)cc2)c(N)c1S(=O)(=O)c1ccccc1,C33058241_decoy,WEE1,Decoy,0.0,-9.9526,-9.12,-0.54,-10.299011772800345
COc1ccc(C(=O)c2sc(Nc3cc(C)ccc3C)c(S(=O)(=O)c3ccc(OC)cc3)c2N)cc1,C33058463_decoy,WEE1,Decoy,0.0,-9.17004,-8.84,-1.35,-9.700459880137185
Cc1ccccc1Nc1sc(C(=O)c2ccc(F)cc2)c(N)c1S(=O)(=O)c1ccc(Cl)cc1,C33058476_decoy,WEE1,Decoy,0.0,-8.74841,-8.58,-4.18,-7.351669190753792
C[C@@H](NC(=O)c1cc(NC(=O)Nc2cccc(C(F)(F)F)c2)ccc1N1CCCC1)c1ccccc1,C33492032_decoy,WEE1,Decoy,0.0,-8.56215,-6.46,-3.94,-6.3713667614599
Nc1c(NC(=O)N2CCC(Cc3ccccc3)CC2)c(-c2ccccc2)nn1-c1ccc(C(F)(F)F)cc1,C34785235_decoy,WEE1,Decoy,0.0,-8.03394,-7.59,-2.89,-7.080799496432464
O=C(N[C@H]1CCCC[C@@H]1NC(=O)c1csc(COc2ccccc2F)n1)NC12CC3CC(CC(C3)C1)C2,C34906387_decoy,WEE1,Decoy,0.0,-10.4891,-8.27,-4.7,-6.586449815835411
O=C(N[C@@H]1CCCC[C@H]1NC(=O)c1csc(COc2ccccc2F)n1)NC12CC3CC(CC(C3)C1)C2,C34906388_decoy,WEE1,Decoy,0.0,-12.0219,-9.72,-2.43,-9.410903840596474
CC[C@H](C)[C@@H](NC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)Nc1nnc(-c2ccc(F)cc2)s1,C35300773_decoy,WEE1,Decoy,0.0,-7.72689,-7.75,-3.8,-7.082060568637767
C=C(C)[C@H]1CC[C@]2(C(=O)OC)CC[C@]3(C)[C@@H](CC[C@H]4[C@@]5(C)C/C(=C/NC(N)=O)C(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12,C35494156_decoy,WEE1,Decoy,0.0,-8.35659,-5.66,-3.02,-5.113487541185396
CC[C@@H](C)[C@H](NC(=O)Nc1cccc(Br)c1)C(=O)Nc1nnc(-c2ccc(F)cc2)s1,C35729065_decoy,WEE1,Decoy,0.0,-9.13167,-6.28,-1.6,-5.465432825223156
CC[C@H](C)[C@H](NC(=O)Nc1cccc(Br)c1)C(=O)Nc1nnc(-c2ccc(F)cc2)s1,C35729066_decoy,WEE1,Decoy,0.0,-8.749,-8.92,-3.54,-7.124465255842039
Cc1ccc2[nH]cc(CCNC(=O)C3=CNN4C(C(F)(F)F)=CC(c5ccc(C(C)C)cc5)=N[C@@H]34)c2c1,C39243147_decoy,WEE1,Decoy,0.0,-9.1053,-9.27,-1.21,-13.7306801675231
COC(=O)C1=C(C)Nc2sc(C(=O)C34CC5CC(CC(C5)C3)C4)c(N)c2[C@H]1c1ccc(C(=O)OC)cc1,C39327028_decoy,WEE1,Decoy,0.0,-8.62851,-7.79,-4.47,-7.45667394014933
Cc1ccc(NC(=O)[C@@H]2C(=O)C[C@](C)(O)[C@@H](C(=O)Nc3ccc(C)cc3C)[C@@H]2c2ccc(F)cc2)c(C)c1,C41006307_decoy,WEE1,Decoy,0.0,-8.67423,-5.77,-3.61,-5.662373271327387
CCc1ccc([C@@H]2[C@@H](C(=O)Nc3ccc(C)cc3C)C(=O)C[C@@](C)(O)[C@@H]2C(=O)Nc2ccc(C)cc2C)cc1,C41006337_decoy,WEE1,Decoy,0.0,-8.97699,-6.18,-3.38,-6.629048479204318
N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)cc3Cl)c2[C@H]1c1ccc(OCc2ccccc2F)cc1,C08854971_decoy,WEE1,Decoy,0.0,-8.38977,-8.97,-1.68,-7.74820280396068
COc1cccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(CC(C)C)cc4)c32)c1OCc1ccc(F)cc1,C00985863_decoy,WEE1,Decoy,0.0,-7.31617,-4.8,-2.02,-4.78931455295973
Cc1ccc(-c2cc(C(F)(F)F)nc(SCCC(=O)Nc3sc4c(c3C(N)=O)CCCC4)n2)cc1,C58970078_decoy,WEE1,Decoy,0.0,-11.4342,-8.46,-1.99,-9.15709525821
COc1cc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2ccc(C)cc2C)ccc1OCc1ccc(Cl)cc1,C59210842_decoy,WEE1,Decoy,0.0,-9.09116,-5.08,-2.34,-5.45667452014205
O=C(CSc1n[nH]c(N/N=C/c2ccc3ccc4cccc5ccc2c3c45)n1)NCc1ccc(F)cc1,C59310282_decoy,WEE1,Decoy,0.0,-8.26799,-9.15,-1.83,-9.029659362396396
C[C@H](NC(=O)CSc1n[nH]c(N/N=C/c2ccc3ccc4cccc5ccc2c3c45)n1)c1ccccc1,C59310292_decoy,WEE1,Decoy,0.0,-10.5294,-11.37,-2.6,-11.478024030047742
C[C@@H](NC(=O)CSc1n[nH]c(N/N=C/c2ccc3ccc4cccc5ccc2c3c45)n1)c1ccccc1,C59310293_decoy,WEE1,Decoy,0.0,-8.49377,-11.75,-2.83,-8.932026520406573
CCC(C)(C)[C@H]1CCc2c(sc3c2C(O)=N[C@@H](c2cc(I)c(O)c(OC)c2)N3)C1,C15945761_decoy,WEE1,Decoy,0.0,-11.4504,-7.46,-4.41,-8.207756003482164
O=C(c1ccccc1)[C@@H]1[C@@H](c2ccc(OCc3ccccc3)cc2)NC(=S)N[C@@]1(O)C(F)(F)F,C06148075_decoy,WEE1,Decoy,0.0,-8.53599,-6.39,-2.73,-6.6312527218232615
O=C(C[C@H]1Nc2ccccc2NC1=O)Nc1ccccc1SC(F)(F)C(F)(F)C(F)(F)F,C01768885_decoy,WEE1,Decoy,0.0,-7.32618,-8.41,-2.33,-9.893939548345047
Cc1ccccc1Nc1sc(C(=O)c2ccccc2)c(N)c1S(=O)(=O)c1ccc(Cl)cc1,C02699225_decoy,WEE1,Decoy,0.0,-9.32695,-8.76,-3.22,-8.452183104716717
CCC(C)(C)[C@@H]1CCc2nc3sc(C(=O)NCCc4ccc(OC)c(OC)c4)c(N)c3cc2C1,C00691897_decoy,WEE1,Decoy,0.0,-9.79715,-6.74,-1.66,-6.285372294381732
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3cc(-c4cccs4)nc4ccccc34)c2C(N)=O)C1,C02086532_decoy,WEE1,Decoy,0.0,-10.1978,-9.97,-1.24,-8.731822717640771
O=C(CC12CC3CC(CC(C3)C1)C2)NC(=S)Nc1cccc(NC(=O)c2cc3ccccc3o2)c1,C08833107_decoy,WEE1,Decoy,0.0,-11.0762,-10.66,-1.34,-15.81333465451768
O=C(CC12CC3CC(CC(C3)C1)C2)NC(=S)Nc1ccc(NC(=O)c2cc3ccccc3o2)cc1,C08835699_decoy,WEE1,Decoy,0.0,-11.2745,-8.57,-3.84,-8.333983231762243
Nc1ncc(-c2ccc(Br)cc2)c(-c2ccc(OCc3ccc(F)cc3)cc2O)n1,C02332062_decoy,WEE1,Decoy,0.0,-9.38688,-8.61,-1.72,-8.668449863724074
C[C@H](CCc1ccccc1)NC(=O)c1c(N)n(/N=C/c2ccc(F)cc2)c2nc3ccccc3nc12,C09459295_decoy,WEE1,Decoy,0.0,-9.85737,-9.69,-3.22,-13.932661223120837
Cc1cc(C)cc(NC(=O)c2c(N)n(/N=C/c3ccc(C(C)C)cc3)c3nc4ccccc4nc23)c1,C02378802_decoy,WEE1,Decoy,0.0,-8.77649,-6.02,-0.79,-5.616456031573134
CC[C@@H]1CCc2nc3sc(C(=O)Nc4ccc(C(C)=O)cc4)c(N)c3c(C(F)(F)F)c2C1,C12858068_decoy,WEE1,Decoy,0.0,-8.18394,-9.58,-1.97,-7.752851171128126
CC[C@]1(C)Cc2c(sc3nc(SCC(=O)Nc4cccc5ccccc45)nc(N)c23)CO1,C02240365_decoy,WEE1,Decoy,0.0,-10.6306,-10.04,-1.18,-9.517379955165556
Cc1cccc(Nc2sc(C(=O)c3ccc(F)cc3)c(N)c2S(=O)(=O)c2ccccc2)c1C,C09824682_decoy,WEE1,Decoy,0.0,-9.47642,-9.82,-1.36,-8.661612392552572
Cc1ccc(S(=O)(=O)Nc2nc3cc(NC(=O)Nc4ccc(C)c(F)c4)ccc3s2)cc1,C13347542_decoy,WEE1,Decoy,0.0,-9.84612,-5.98,-1.88,-5.722349949222266
Cc1ccc(C(=O)NNC(=S)NC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)cc1,C02727077_decoy,WEE1,Decoy,0.0,-7.83663,-9.03,-4.5,-7.323120177200042
Cc1ccc(NC(=S)Nc2ccc(S(=O)(=O)Nc3cc(Cl)cc(Cl)c3)cc2)c(C)c1,C13937387_decoy,WEE1,Decoy,0.0,-9.26916,-5.43,-2.88,-5.585842209553601
COc1c(C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc2ccccc2c1Br,C14273349_decoy,WEE1,Decoy,0.0,-9.26802,-9.13,-0.57,-16.46286790330853
O=S(=O)(NC1CCCCC1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc(Cl)cc(Cl)c1O)N2,C14466877_decoy,WEE1,Decoy,0.0,-10.2573,-9.95,-1.19,-8.170300484186475
Cc1cccc(C)c1NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2,C14544898_decoy,WEE1,Decoy,0.0,-8.61626,-10.19,-1.39,-7.747147191491193
Cc1c(Cc2ccccc2)sc(NC(=O)c2cc(Br)ccc2OC(C)C)c1C(N)=O,C14667581_decoy,WEE1,Decoy,0.0,-9.93221,-5.51,-1.6,-5.95862734411918
Cc1ccc(NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1S(=O)(=O)Nc1ccc(F)cc1,C16044981_decoy,WEE1,Decoy,0.0,-9.50609,-11.47,-4.16,-11.86984193389107
Cc1ccc(S(=O)(=O)c2c(Nc3ccccc3F)sc(C(=O)c3ccccc3)c2N)cc1,C20418300_decoy,WEE1,Decoy,0.0,-8.4251,-9.03,-3.13,-7.581537618561236
CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc(Cl)cc(Cl)c1O)N2,C20701853_decoy,WEE1,Decoy,0.0,-9.62249,-8.48,-1.1,-8.634838275362346
CCCc1n[nH]c2c1[C@H](c1ccc(OC)c(CSc3nc4ccccc4s3)c1)C(C#N)=C(N)O2,C22748005_decoy,WEE1,Decoy,0.0,-9.62086,-10.17,-1.39,-15.966166177616664
Nc1nc(SCC(=O)Nc2ccc(Br)cc2F)nc2sc3c(c12)CCCC3,C23590736_decoy,WEE1,Decoy,0.0,-10.4208,-8.73,-0.64,-11.430684559035392
O=C(Nc1cccc2ccccc12)/C(=C\c1ccc(O)cc1)NC(=O)c1ccc(Br)cc1,C28308880_decoy,WEE1,Decoy,0.0,-9.2191,-10.31,-2.95,-9.07288035618516
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)c2c[nH]c3ccccc23)cc1,C30574858_decoy,WEE1,Decoy,0.0,-9.16075,-9.51,-2.2,-7.89269312093276
CC[C@H](C(=O)Nc1scc(-c2ccc(C)cc2)c1C(N)=O)n1c(=O)cc(C)c2cc(C)cc(C)c21,C32527475_decoy,WEE1,Decoy,0.0,-7.97992,-7.59,-2.15,-6.821643923847162
O=C(Nc1ccc(Br)cc1)Nc1cc(NC(=O)c2ccccc2)ccc1N1CCCC1,C33009449_decoy,WEE1,Decoy,0.0,-8.46152,-9.21,-2.94,-8.595999354198405
O=C(Nc1cc(NC(=O)c2ccccc2)ccc1N1CCCCC1)Nc1ccccc1C(F)(F)F,C33009614_decoy,WEE1,Decoy,0.0,-8.24758,-6.83,-1.83,-6.655730815745074
Cc1ccc(C)c(NC(=O)Nc2ccc3nc(SCC(=O)Nc4ccc(F)cc4)sc3c2)c1,C33018421_decoy,WEE1,Decoy,0.0,-9.8658,-9.64,-3.28,-10.225122790388648
Cc1ccc(NC(=O)Nc2ccc3nc(SCC(=O)Nc4ccc(C)c(C)c4)sc3c2)cc1,C33019106_decoy,WEE1,Decoy,0.0,-9.11919,-8.52,-3.45,-7.053969228710077
Cc1ccc(C(=O)c2sc(Nc3cccc(Cl)c3)c(S(=O)(=O)c3ccccc3)c2N)cc1,C33058266_decoy,WEE1,Decoy,0.0,-8.6246,-9.29,-3.95,-8.741548403899317
Cc1ccc(S(=O)(=O)c2c(Nc3ccc(F)cc3)sc(C(=O)c3ccccc3)c2N)cc1,C33058379_decoy,WEE1,Decoy,0.0,-7.73798,-8.92,-0.79,-9.19564151597358
CCOc1cc(/C=N/NC(N)=S)cc(Br)c1OCc1ccc(Br)cc1,C08921277_decoy,WEE1,Decoy,0.0,-10.0064,-7.44,-3.51,-7.533595378395701
CCCOc1ccc(Br)cc1[C@H]1NC(=S)NC(C)=C1C(=O)Nc1ccc(C)cc1,C18093885_decoy,WEE1,Decoy,0.0,-8.77419,-8.21,-1.75,-8.378924958110241
Cc1cccc(NC(=O)NCCN(C(=O)Nc2cccc(C(F)(F)F)c2)c2ccc(F)cc2)c1,C34976345_decoy,WEE1,Decoy,0.0,-7.19151,-9.86,-3.72,-8.195428294972201
Cc1ccc(NC(=O)N(CCCNC(=O)Nc2cccc(C(F)(F)F)c2)c2ccc(F)cc2)cc1,C35095088_decoy,WEE1,Decoy,0.0,-7.32509,-8.73,-2.38,-7.994553526452519
CC[C@H](C)[C@@H](NC(=O)Nc1ccc(Cl)cc1Cl)C(=O)Nc1nnc(-c2ccc(C)cc2)s1,C35268318_decoy,WEE1,Decoy,0.0,-8.97067,-6.25,-4.97,-5.932651147427007
Nc1c2c(-c3ccc(Cl)cc3)nc(NCc3ccc(F)cc3)nc2nn1-c1cccc(F)c1,C35573885_decoy,WEE1,Decoy,0.0,-8.49369,-10.3,-0.81,-9.941660019052229
CC[NH+](CC)c1ccc([C@@H]2Nc3ccc(S(=O)(=O)Nc4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1,C14461383_decoy,WEE1,Decoy,0.0,-10.0363,-9.39,-3.73,-8.791529545017525
C[C@@H]1[C@@H](NC(=O)c2ccc(-n3nc(-c4cccc(C(F)(F)F)c4)cc3N)cc2)C[C@H]2C[C@@H]1C2(C)C,C38737195_decoy,WEE1,Decoy,0.0,-8.95232,-9.6,-2.15,-7.255444925058168
Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=S)N[C@H]3C[C@@H](C)CC(C)(C)C3)cc2)c(C)c1,C39974291_decoy,WEE1,Decoy,0.0,-9.03979,-8.54,-2.61,-7.288321503092017
Cc1ccc(C(=O)NNC(=O)c2oc3c(c2C)/C(=N/Nc2cccc(C(F)(F)F)c2)CCC3)cc1,C40824060_decoy,WEE1,Decoy,0.0,-8.68252,-9.74,-3.19,-7.315728914579422
CC(C)(C)C1CCC(NC(=O)c2ccc(-n3nc(-c4ccc(Cl)c(Cl)c4)cc3N)cc2)CC1,C38744181_decoy,WEE1,Decoy,0.0,-10.5133,-9.4,-1.25,-12.033439488463085
CC(C)(C)c1ccc(C(=O)Nc2cccc(NC(=S)NC(=O)c3cc4ccccc4o3)c2)cc1,C22707748_decoy,WEE1,Decoy,0.0,-10.2421,-10.13,-2.47,-13.222717270622816
CC(C)(C)NC(=O)c1sc2c(NC(=S)NC(=O)CC34CC5CC(CC(C5)C3)C4)cccc2c1Cl,C59294295_decoy,WEE1,Decoy,0.0,-9.89506,-9.3,-2.88,-8.18824990745183
Cc1ccc2nc(-c3ccc(F)c(C)c3)c(CC(=O)Nc3sc4c(c3C(N)=O)CC[C@H](C)C4)n2c1,C62039579_decoy,WEE1,Decoy,0.0,-8.31797,-9.53,-3.81,-9.392265305421304
[H]/N=C1/N=C(c2ccc(F)cc2)/C(=N/Nc2cc(S(=O)(=O)Nc3ccc(C)cc3C)ccc2C)S1,C09507842_decoy,WEE1,Decoy,0.0,-9.55126,-5.44,-4.54,-5.387750254927027
O=C(CNc1ccc(Cl)cc1Cl)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1,C66192404_decoy,WEE1,Decoy,0.0,-9.40021,-6.71,-3.17,-7.284556846272059
C[C@H]1CCc2c(sc3nc(SCC(=O)NCc4ccco4)nc(N)c23)C1,C02336476_decoy,WEE1,Decoy,0.0,-9.82912,-8.75,-0.81,-9.144009607596656
CCc1n[nH]c2c1[C@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2,C00987536_decoy,WEE1,Decoy,0.0,-8.92102,-5.35,-1.27,-5.513429344669107
Cc1ccc(NC(=O)Nc2ccc(N3CCCC3)c(C(=O)NC(C)C)c2)cc1,C00747466_decoy,WEE1,Decoy,0.0,-8.17235,-8.9,-1.35,-7.994402744068183
Cc1ccc(-c2nnc(SCC(=O)Nc3ccc(Cl)cc3)n2N)cc1,C03271716_decoy,WEE1,Decoy,0.0,-8.65187,-7.78,-0.62,-7.142031806356436
Cc1cc(O[C@H](C)C(=O)NNC(=O)NC2CCCCC2)cc(C)c1Cl,C02853175_decoy,WEE1,Decoy,0.0,-8.06294,-7.81,-3.58,-4.568558322785225
O=[N+]([O-])c1ccc(NC(=S)NCc2ccc3[nH]c4c(c3c2)CCCC4)cc1,C04925197_decoy,WEE1,Decoy,0.0,-7.90835,-9.12,-2.03,-8.136670492520466
O=C(Nc1ccccc1)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1,C00676474_decoy,WEE1,Decoy,0.0,-7.80379,-7.56,-5.17,-5.721417101748066
O=C(NNC(=O)C1CCCCC1)c1ccc(NC(=O)C2CCCCC2)cc1,C06883022_decoy,WEE1,Decoy,0.0,-8.34327,-8.88,-1.43,-7.589454949916789
Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3c(C)cc(C)cc3C)n2N)cc1,C03500101_decoy,WEE1,Decoy,0.0,-8.26095,-8.87,-2.4,-9.23456883980412
O=C(/C=C/c1c(Cl)nc2ccccn12)NNC(=S)NC1CCCCC1,C15874382_decoy,WEE1,Decoy,0.0,-8.85837,-8.09,-0.93,-8.91504932484339
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H]2C[C@H]2c2ccc(C(C)(C)C)cc2)cc1,C17080407_decoy,WEE1,Decoy,0.0,-7.71255,-9.95,-3.07,-7.215921925623006
CC(C)(C)c1nnc(SCC(=O)Nc2cc(Cl)cc(Cl)c2)n1N,C20841848_decoy,WEE1,Decoy,0.0,-9.91425,-6.93,-2.36,-6.906547398547235
O=C(/C=C/c1cc(Cl)c2c(c1)OCO2)NNC(=S)NC1CCCC1,C22645317_decoy,WEE1,Decoy,0.0,-9.61956,-8.3,-2.21,-7.784737368616403
Cc1c(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)oc2c(F)cccc12,C23009431_decoy,WEE1,Decoy,0.0,-9.07506,-9.32,-2.04,-9.051808293102953
Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3cc(F)ccc3C)n2N)cc1,C23357841_decoy,WEE1,Decoy,0.0,-8.41644,-9.81,-1.86,-11.994842830445652
Cc1nc(N)sc1C(=O)N/N=C\c1ccccc1OCc1ccccc1,C31854400_decoy,WEE1,Decoy,0.0,-6.8008,-7.14,-1.34,-6.662525645877835
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)NC1CCCCC1,C06251736_decoy,WEE1,Decoy,0.0,-8.82328,-8.54,-3.14,-7.386425357867962
C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)c1nc(Cl)c(Cl)c(N)c1Cl,C35380549_decoy,WEE1,Decoy,0.0,-8.69311,-7.59,-3.45,-6.718337315288272
CC[C@H](C)Nc1ncnc(Oc2ccc(Br)c3cccnc23)c1N,C40796853_decoy,WEE1,Decoy,0.0,-7.55076,-8.0,-1.33,-7.439171759452728
COc1ccccc1NC(=O)c1ccc(NC(=O)N[C@@H](C)c2ccccc2)cc1,C43657839_decoy,WEE1,Decoy,0.0,-8.09452,-10.87,-1.21,-8.861483482045738
CC(C)(C)NC(=O)c1ccc(NC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1,C44016887_decoy,WEE1,Decoy,0.0,-7.97053,-7.32,-1.64,-6.6239152116697655
CC(C)NC(=O)C(=O)NNC(=O)C1(c2ccc(C(C)(C)C)cc2)CCCCC1,C44020728_decoy,WEE1,Decoy,0.0,-7.38629,-9.14,-3.97,-6.684163321871467
CC(C)CC(=O)Nc1ccc(NC(=O)NCc2nc3ccccc3s2)cc1,C44031187_decoy,WEE1,Decoy,0.0,-8.0814,-8.64,-0.99,-10.966895311764084
C[C@H](NC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(OC(F)F)cc1,C46613779_decoy,WEE1,Decoy,0.0,-6.54267,-8.68,-1.73,-7.118059225502497
Cc1cccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1,C46704520_decoy,WEE1,Decoy,0.0,-7.8055,-8.69,-3.06,-6.72227553709409
C[C@@H](NC(=O)N(C)[C@@H](C)c1cccs1)c1ccc(NC(=O)NC2CC2)cc1,C47128881_decoy,WEE1,Decoy,0.0,-9.52657,-8.38,-1.86,-8.373292656483098
CC(C)(C)[C@H](NC(=O)Nc1cccc(N2CCNC2=O)c1)c1cccs1,C47521851_decoy,WEE1,Decoy,0.0,-7.67012,-7.69,-3.83,-6.842472963234873
O=C(NC[C@H]1Cc2ccccc2O1)Nc1ccc(C(=O)NC2CCCC2)cc1,C47757657_decoy,WEE1,Decoy,0.0,-8.13956,-8.47,-1.93,-6.769172386677809
C[C@@H](NC(=O)Nc1cccc2c1CCCC2)c1cccc(NS(C)(=O)=O)c1,C48052399_decoy,WEE1,Decoy,0.0,-7.77613,-10.4,-1.76,-8.149186486144934
CC(=O)Nc1ccc(C)c(NC(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)c1,C48271078_decoy,WEE1,Decoy,0.0,-6.86984,-9.32,-3.85,-7.101967806968805
CCOc1ccc(-c2n[nH]c3c2[C@H](c2ccc(SC)cc2)C(C#N)=C(N)O3)cc1,C05149619_decoy,WEE1,Decoy,0.0,-6.60763,-4.93,-1.16,-4.806428486885402
Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2C)c1,C53546460_decoy,WEE1,Decoy,0.0,-7.76712,-8.92,-4.38,-6.070518317535249
CNS(=O)(=O)c1ccc([C@H](C)NC(=O)Nc2cccc(C(C)C)c2)cc1,C54382984_decoy,WEE1,Decoy,0.0,-7.28277,-8.16,-3.11,-7.509229491154738
Cc1ccc([C@H](C)NC(=O)NNC(=O)[C@H](C)Oc2cccc(C)c2C)s1,C54733541_decoy,WEE1,Decoy,0.0,-7.86601,-8.05,-2.3,-6.9878037875236565
Cc1ccc(S(=O)(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)c(C)c1,C56069976_decoy,WEE1,Decoy,0.0,-7.04031,-7.36,-3.6,-6.692747988118094
COc1c(F)cc(N[C@@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)cc1F,C56207217_decoy,WEE1,Decoy,0.0,-7.64301,-8.16,-3.6,-6.810717829323433
O=C(Nc1cccc(C(=O)Nc2ccccc2OC(F)(F)F)c1)NC1CC1,C56344573_decoy,WEE1,Decoy,0.0,-7.08824,-9.23,-2.67,-8.172882744603662
C[C@H](NC(=O)/C=C/c1ccccn1)c1ccc(NC(=O)Nc2ccccc2)cc1,C58278104_decoy,WEE1,Decoy,0.0,-6.84501,-9.37,-2.49,-6.249377083525119
C[C@@H](Sc1nc(-c2ccccc2)cn1N)C(=O)Nc1nc2ccccc2s1,C58984914_decoy,WEE1,Decoy,0.0,-9.83407,-6.15,-1.65,-6.115274290558739
CN(C)c1ccc(N/C(N)=N/c2nc(C(F)(F)F)cc(C(F)(F)F)n2)cc1,C13572280_decoy,WEE1,Decoy,0.0,-6.1769,-8.89,-0.0,-7.353979722543373
CC[NH+](CC)c1ccc([C@@H]2C(C#N)=C(N)OC3=NN=C(c4ccccc4)[C@H]32)cc1,C01025752_decoy,WEE1,Decoy,0.0,-8.28667,-8.31,-0.99,-8.756331457940922
CCOC(=O)/C=C1/CS[C@H](NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)N1,C38663959_decoy,WEE1,Decoy,0.0,-8.91433,-9.31,-0.67,-8.179719787744133
COc1ccc(NC(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c(C)c1,C66164443_decoy,WEE1,Decoy,0.0,-7.31166,-8.01,-1.97,-7.768447239822649
O=C(NCC1CC1)NNC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1,C66338335_decoy,WEE1,Decoy,0.0,-8.92324,-8.02,-1.24,-7.736922361333359
CC(C)Oc1ccc(F)cc1NC(=O)c1cccc(NC(=O)NC2CC2)c1,C66678629_decoy,WEE1,Decoy,0.0,-7.77233,-8.71,-0.85,-9.019910387044408
C[C@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)NNC(=O)CC1CCCCC1,C66790219_decoy,WEE1,Decoy,0.0,-8.25679,-7.65,-2.55,-7.240040046177095
COc1ccc([C@@H](NC(=O)Nc2cc(NC(C)=O)c(F)cc2F)C(C)C)cc1,C66980469_decoy,WEE1,Decoy,0.0,-8.31433,-8.16,-2.88,-8.494639453807299
C[C@H](CN(C)C(=O)Nc1cc(C(N)=O)ccc1N1CCCCC1)c1ccccc1,C67014427_decoy,WEE1,Decoy,0.0,-8.61109,-9.47,-2.85,-11.660922986467886
Cc1ccsc1C(=O)NNC(=O)NCc1ccc(Oc2ccccc2)cc1,C67081504_decoy,WEE1,Decoy,0.0,-7.72836,-9.57,-2.88,-7.587736279949193
C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NC(C)(C)c1ccc(Cl)cc1,C67470880_decoy,WEE1,Decoy,0.0,-7.35906,-8.22,-3.93,-7.689157766084776
CNc1ccc2oc(C[C@H]3O[C@@]4(CC[C@@H]3C)O[C@@H]([C@@H](C)C(=O)c3ccc[nH]3)[C@@H](C)C[C@H]4C)nc2c1C(=O)[O-],C03871342_decoy,WEE1,Decoy,0.0,-7.89373,-8.26,-2.65,-7.344096986594324
CC(C)C1=C[C@]23CC[C@@H]4[C@](C)(CCC[C@]4(C)C(=O)[O-])[C@@H]2C[C@H]1[C@H]1C(=O)N(c2ccc(S(N)(=O)=O)cc2)C(=O)[C@H]13,C01896168_decoy,WEE1,Decoy,0.0,-9.03669,-5.28,-4.48,-5.980172351066021
COc1cc(/C=C2/NC(=O)N(CC(=O)Nc3cccc(C)c3)C2=O)ccc1OCc1cccc(C(=O)[O-])c1,C08451820_decoy,WEE1,Decoy,0.0,-9.56289,-8.0,-2.22,-6.838463566379877
C[C@]12C=C/C(=N\OCC(=O)NC[C@@H](CC(=O)[O-])c3ccccc3)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O,C08789614_decoy,WEE1,Decoy,0.0,-7.68885,-8.34,-3.95,-4.67731617883691
Cc1ccc([C@H]2c3sc(=O)[nH]c3S[C@@H]3[C@H]4C[C@H]([C@@H]5C(=O)N([C@@H](CC(C)C)C(=O)[O-])C(=O)[C@@H]45)[C@@H]23)cc1,C11859663_decoy,WEE1,Decoy,0.0,-8.81197,-5.46,-1.72,-7.1171272395874885
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)NCC(C)(C)[C@@H](O)C(=O)[O-])CC[C@@]4(C)[C@@H]3CC[C@]12C,C12296652_decoy,WEE1,Decoy,0.0,-8.70739,-8.26,-2.92,-7.134215971029689
O=C(Nc1cccc(C(=O)[O-])c1)/C(=C\c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccc(Br)cc1,C15768464_decoy,WEE1,Decoy,0.0,-8.16149,-6.31,-3.05,-5.836739017608041
COc1cc(/N=C/c2cc(Br)cc([N+](=O)[O-])c2[O-])ccc1NC(=O)c1cc2ccccc2o1,C16195946_decoy,WEE1,Decoy,0.0,-7.33311,-8.88,-2.64,-6.5179732508434665
CC(C)OC(=O)c1c(-c2ccc(C3CCCCC3)cc2)csc1NC(=O)[C@H]1[C@@H](C(=O)[O-])[C@H]2CC[C@@H]1O2,C17136303_decoy,WEE1,Decoy,0.0,-11.3768,-7.79,-0.43,-15.910653102921406
NS(=O)(=O)c1ccc(N2C(=O)C([O-])=C(C(=O)c3ccc(Cl)cc3)[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1,C06296790_decoy,WEE1,Decoy,0.0,-7.98848,-8.79,-3.11,-7.218956326261076
COc1cc([C@H]2C(C(=O)OCC(C)C)=C(C)NC3=C2C(=O)C[C@@H](c2cccs2)C3)cc([N+](=O)[O-])c1[O-],C19848268_decoy,WEE1,Decoy,0.0,-8.09493,-6.02,-1.25,-5.872419057026386
Cc1ccc(C2=NN(C3=NC(=O)[C@H](CC(=O)Nc4cccc(C(=O)[O-])c4)S3)[C@@H](c3cccs3)C2)cc1,C28156588_decoy,WEE1,Decoy,0.0,-9.23452,-9.02,-3.84,-7.729064399107672
COc1cc(OC)cc(C(=O)Nc2ccc(F)cc2S(=O)(=O)[N-]c2ccc(Br)cc2)c1,C28284270_decoy,WEE1,Decoy,0.0,-7.96145,-9.17,-1.5,-8.266303992630926
C[C@@]12C=C/C(=N\OCC(=O)N[C@@H](Cc3ccccc3)C(=O)[O-])C=C1CC[C@H]1[C@H]2CC[C@]2(C)[C@H]1CC[C@@]2(C)O,C34716129_decoy,WEE1,Decoy,0.0,-9.93032,-10.47,-3.48,-3.092920296224922
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1ccccc1C,C35692948_decoy,WEE1,Decoy,0.0,-8.12378,-7.12,-2.4,-6.887184153458444
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc4c(c3)OCO4)N2[C@@H]1c1ccc(C)cc1,C35697282_decoy,WEE1,Decoy,0.0,-8.83816,-8.21,-2.15,-7.59967806888088
CC1=C(C(=O)OC(C)C)[C@H](c2ccc(C(F)(F)F)cc2)N2C(/C=C(\[O-])NCc3ccco3)=CSC2=N1,C35701846_decoy,WEE1,Decoy,0.0,-8.13877,-4.44,-2.33,-5.016868902911865
CC1=C(C(=O)OC(C)C)[C@H](c2ccc(C(F)(F)F)cc2)N2C(/C=C(\[O-])NC[C@H]3CCCO3)=CSC2=N1,C35701875_decoy,WEE1,Decoy,0.0,-8.20188,-7.44,-4.18,-7.389794298001855
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@H]1c1ccccc1C,C35703566_decoy,WEE1,Decoy,0.0,-8.32773,-7.73,-2.11,-9.99886809684405
CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccccc2F)N2C(/C=C(\[O-])NC[C@@H]3CCCO3)=CSC2=N1,C35703712_decoy,WEE1,Decoy,0.0,-8.65052,-8.73,-2.04,-7.743651984810763
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1cc(C)ccc1C,C35705159_decoy,WEE1,Decoy,0.0,-6.98267,-4.88,-3.04,-4.238605473429598
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@@H]1c1cccc(C)c1,C36050041_decoy,WEE1,Decoy,0.0,-8.7231,-7.2,-3.24,-6.7130435675090325
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc4c(c3)OCO4)N2[C@@H]1c1cc(C)ccc1C,C36050332_decoy,WEE1,Decoy,0.0,-7.17653,-8.13,-1.79,-7.195402058005474
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc4c(c3)OCO4)N2[C@@H]1c1ccccc1C,C36053125_decoy,WEE1,Decoy,0.0,-8.20306,-8.27,-2.46,-7.932298096691958
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1cccc(Oc2ccccc2)c1,C36065076_decoy,WEE1,Decoy,0.0,-10.1939,-6.95,-4.15,-8.506347666410413
CC1=C(C(=O)Nc2ccccc2)[C@H](c2cc(C)ccc2C)N2C(/C=C(\[O-])NC[C@@H]3CCCO3)=CSC2=N1,C36072010_decoy,WEE1,Decoy,0.0,-9.24476,-6.26,-3.03,-6.080418851719513
CC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=C/C(=N\OCC(=O)NCC(C)(C)[C@H](O)C(=O)[O-])CC[C@@]4(C)[C@@H]3CC[C@@]21C,C36369743_decoy,WEE1,Decoy,0.0,-8.37547,-8.65,-1.82,-6.716982804291765
Cc1ccc(N2C(=O)NC([O-])=C3C2=NC(=O)[C@]3(NC(=O)c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1,C01876431_decoy,WEE1,Decoy,0.0,-5.76978,-6.57,-2.09,-4.146261714727991
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1[O-])[C@H](C(=O)NC(C)(C)C)c1cc2ccccc2c2ccccc12,C36570126_decoy,WEE1,Decoy,0.0,-6.04958,-4.34,-2.31,-4.642201352434979
Cc1ccc(CN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@H](C(=O)NC(C)(C)C)c2ccc3c(c2)OCO3)o1,C36596764_decoy,WEE1,Decoy,0.0,-6.49591,-4.95,-4.07,-5.07315303572207
CC(=O)O[C@H]1C[C@@]2(C)[C@@H](CC[C@@H]3[C@]4(C)CCC(=O)[C@H](C)[C@@H]4[C@H](O)C(=O)[C@]32C)/C1=C(/CCC=C(C)C)C(=O)[O-],C35457239_decoy,WEE1,Decoy,0.0,-7.1928,-4.43,-2.43,-4.248111084565736
O=C([O-])c1c2c(nc3ccc(S(=O)(=O)N4CCC(C(=O)NC5CCCCCC5)CC4)cc13)CCCC2,C09970047_decoy,WEE1,Decoy,0.0,-9.73904,-10.78,-2.83,-8.903919090197272
CCOC(=O)[C@@H]1C2=C(CCCCC2)S[C@H]1NC(=O)[C@@H](C)Sc1nnc2nc([O-])c3c(n12)CCCC3,C39733515_decoy,WEE1,Decoy,0.0,-9.89314,-8.96,-1.6,-8.378583951528977
CCCCN/C([O-])=N/S(=O)(=O)c1ccc(NC(=O)c2oc3c(c2C)C2(CCC3)SCCS2)cc1,C39852041_decoy,WEE1,Decoy,0.0,-8.94235,-9.42,-3.84,-8.471040194907562
O=C(C1=C([O-])C(=O)N(CCO)[C@H]1/C=C/c1ccccc1)c1ccc(S(=O)(=O)N2CCCCCC2)cc1,C40112207_decoy,WEE1,Decoy,0.0,-9.70531,-6.04,-3.04,-5.372121473185841
Cc1ccccc1NC(=O)[C@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)Nc2ccccc2C)[C@H]1c1ccccc1C(=O)[O-],C41006503_decoy,WEE1,Decoy,0.0,-6.60512,-5.37,-2.97,-4.935823664435167
C#C[C@]1(O)CC[C@@H]2[C@H]3CCC4=C/C(=N\OCC(=O)N[C@@H](C(=O)[O-])c5ccccc5)CC[C@@]4(C)[C@H]3CC[C@]21C,C43736727_decoy,WEE1,Decoy,0.0,-8.09211,-8.93,-4.2,-6.888775600907005
COC(=O)c1cc(NC(=O)c2ccc([N-]S(=O)(=O)c3ccc(C)cc3)cc2Cl)cc(C(=O)OC)c1,C44885138_decoy,WEE1,Decoy,0.0,-10.466,-10.3,-2.89,-17.00411798008417
Cc1ccc(SCc2ccc(C(=O)Nc3ccc(S(=O)(=O)[N-]c4nc(C)cc(C)n4)cc3)cc2)cc1,C44900885_decoy,WEE1,Decoy,0.0,-9.49115,-9.16,-2.04,-7.987991384915791
C[C@]12CC/C(=N\OCC(=O)N[C@H](Cc3ccccc3)C(=O)[O-])C=C1CC[C@@H]1[C@H]2CC[C@@]2(C)[C@@H]1CC[C@]2(C)O,C51336632_decoy,WEE1,Decoy,0.0,-9.58427,-7.38,-4.63,-6.38092356230522
Cc1ccc(CSc2nc([O-])c3c(n2)NC2=C(C(=O)CCC2)[C@H]3c2cc3c(cc2[N+](=O)[O-])OCO3)cc1,C33810219_decoy,WEE1,Decoy,0.0,-6.95964,-10.48,-1.64,-6.58895009558172
COc1ccc([C@H]2/C(=C(\[O-])Nc3cc(C)ccc3C)C(=O)C[C@](C)(O)[C@H]2C(=O)Nc2cc(C)ccc2C)cc1,C54621984_decoy,WEE1,Decoy,0.0,-8.39049,-4.63,-4.18,-5.05650783125869
N#C/C(=C/Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)c1nc(-c2ccc3ccccc3c2)cs1,C08741095_decoy,WEE1,Decoy,0.0,-10.2836,-10.06,-2.24,-10.197019092981884
N/C(=N\c1nc([O-])cc(CSc2nnnn2-c2ccccc2)n1)Nc1ccc(Oc2ccccc2)cc1,C20503075_decoy,WEE1,Decoy,0.0,-8.78883,-6.31,-1.95,-6.232633740361118
C[C@H](SC1=NC(=C2C=CC(=O)C=C2)C(=C2C=CC(=O)C=C2)N[N-]1)C(=O)c1ccc(N2CCCC2=O)cc1,C13566989_decoy,WEE1,Decoy,0.0,-9.52732,-10.15,-2.46,-10.417363947777517
CCOC(=O)c1ccc(NC(=O)C[C@@H]2SC([N-]/N=C3/CCCCCCCCCC[C@H]3C)=NC2=O)cc1,C22505969_decoy,WEE1,Decoy,0.0,-9.19445,-8.45,-3.28,-8.732587379820327
COc1ccccc1[N-]S(=O)(=O)c1cc([N+](=O)[O-])ccc1N/N=C/c1ccc(N2CCOCC2)cc1,C12561845_decoy,WEE1,Decoy,0.0,-8.06932,-8.39,-1.65,-8.735214659725836
CCOC(=O)c1c(NC(=O)CSc2nc([O-])c3cnn(-c4ccccc4)c3n2)sc2c1CCCC2,C02717791_decoy,WEE1,Decoy,0.0,-8.66259,-8.27,-1.62,-9.163975267589056
Cc1ccc(S(=O)(=O)/N=C(\N/C([S-])=N/c2c(C)n(C)n(-c3ccccc3)c2=O)c2ccccc2)cc1,C17746827_decoy,WEE1,Decoy,0.0,-7.29763,-9.75,-2.9,-7.784861932284412
O=S(=O)(/N=C1/CCCCCN1)c1ccc2sc([N-]S(=O)(=O)c3ccc4ccccc4c3)nc2c1,C13132644_decoy,WEE1,Decoy,0.0,-10.6527,-10.56,-2.72,-10.809752974437178
Cc1cc(C(=O)Nc2sc3c(c2C(N)=O)CCCCC3)c(C)o1,C02759422_decoy,WEE1,Decoy,0.0,-8.72372,-8.63,-0.16,-8.459128335820129
C[C@H]1CCc2c(sc(NC(=O)c3ccco3)c2C(N)=O)C1,C00218408_decoy,WEE1,Decoy,0.0,-8.39295,-7.98,-0.09,-8.389646074244785
CC(=O)[C@H]1[C@@H](c2sccc2C)NC(=O)N[C@@]1(O)C(F)(F)F,C04387637_decoy,WEE1,Decoy,0.0,-7.79215,-4.9,-2.42,-5.001950631725268
Cc1ccc([C@@H]2NNC(=O)[C@@H]2NC(=O)c2ccc(F)cc2)cc1,C00465328_decoy,WEE1,Decoy,0.0,-7.08116,-9.09,-1.48,-8.90139952023428
NC(=O)[C@H]1CCCN(C(=O)Nc2cccc(C(F)(F)F)c2)C1,C04722332_decoy,WEE1,Decoy,0.0,-6.26468,-7.28,-2.59,-6.320891021425172
CCCc1n[nH]c2c1[C@@H](c1ccccc1C)C(C#N)=C(N)O2,C00619816_decoy,WEE1,Decoy,0.0,-6.20582,-9.06,-0.61,-7.106833258346314
CNC(=O)NC(=O)[C@H](C)Nc1ccc(Br)cc1,C06911505_decoy,WEE1,Decoy,0.0,-6.35113,-7.14,-2.21,-6.9899257657223925
CC(=O)Nc1ccc(NC(=O)c2cc(Br)c[nH]2)cc1,C13002436_decoy,WEE1,Decoy,0.0,-6.95902,-7.43,-2.11,-7.391520953373869
NNC(=O)c1sc2cc(C(F)(F)F)cnc2c1-c1ccco1,C04052991_decoy,WEE1,Decoy,0.0,-6.47946,-7.04,0.24,-6.920428053251438
NS(=O)(=O)c1ccc(C(=O)NC2CCCCCCC2)cc1,C15613361_decoy,WEE1,Decoy,0.0,-8.33904,-4.83,-1.1,-3.9210427823156846
NS(=O)(=O)c1ccc(NC(=O)c2csc3ccccc23)cc1,C16604742_decoy,WEE1,Decoy,0.0,-8.57402,-8.97,-1.15,-11.725355908627302
CCCc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)s1,C05130866_decoy,WEE1,Decoy,0.0,-7.75173,-4.69,-0.0,-3.998883322711432
NC1=Nc2nc3ccccc3n2[C@@H](c2c(F)cccc2F)N1,C07127402_decoy,WEE1,Decoy,0.0,-7.19479,-8.31,-1.2,-7.333437104599709
Nc1sc2c(c1C(=O)c1ccc3c(c1)NC(=O)CO3)CCC2,C19776244_decoy,WEE1,Decoy,0.0,-8.36805,-6.6,0.22,-7.104998512983003
CC(C)(C)NC(=O)[C@@H]1Cc2nc[nH]c2[C@H](c2ccc(F)cc2)N1,C35918680_decoy,WEE1,Decoy,0.0,-6.66051,-7.75,-1.94,-8.249312381715908
Cc1c(N)cc(S(=O)(=O)N2CCC(CO)CC2)cc1Cl,C36720933_decoy,WEE1,Decoy,0.0,-8.55873,-8.09,-1.92,-10.341227572007028
C[C@H]1CCC[C@H](NC(=O)c2cccc(S(N)(=O)=O)c2)C1,C37252996_decoy,WEE1,Decoy,0.0,-7.52536,-5.94,-1.65,-3.128505565675796
C[C@H](CN1C(=O)NC2(CCCCCCC2)C1=O)C(N)=S,C36678185_decoy,WEE1,Decoy,0.0,-7.92369,-7.12,-2.69,-11.096498635132669
NS(=O)(=O)c1cccc(NC(=O)[C@H]2C[C@H]3CC[C@@H]2C3)c1,C40217003_decoy,WEE1,Decoy,0.0,-7.10642,-5.3,-0.95,-5.490966984341088
Cc1cc(NC(=O)c2ccc(Br)c(N)c2)n(C)n1,C40295459_decoy,WEE1,Decoy,0.0,-7.33579,-8.65,0.02,-7.814208987758676
NS(=O)(=O)c1ccc(Cl)c(NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2C3)c1,C40378798_decoy,WEE1,Decoy,0.0,-8.5393,-7.06,-0.35,-7.373221772815618
NS(=O)(=O)c1ccc(NC(=O)[C@H]2C[C@@H]3C=C[C@H]2C3)c(F)c1,C40381431_decoy,WEE1,Decoy,0.0,-7.36968,-8.78,-4.53,-5.270178841031466
C[C@@H]1c2ccsc2CCN1S(=O)(=O)c1ccccc1NN,C42782260_decoy,WEE1,Decoy,0.0,-6.70479,-4.63,-2.07,-4.222766271712668
N/C(=N/O)c1cc2c(nc1Oc1ccc(Cl)cc1)CCC2,C43407931_decoy,WEE1,Decoy,0.0,-8.48832,-7.81,-0.9,-8.54674730637193
N/C(=N\O)c1ccc(N2CCN(c3ccc(F)cc3)CC2)cc1,C44551576_decoy,WEE1,Decoy,0.0,-8.18769,-5.25,-1.57,-4.108137786399532
[NH3+]C1(C(=O)N2CCc3sccc3[C@@H]2C(=O)[O-])CCCCC1,C44592611_decoy,WEE1,Decoy,0.0,-6.60927,-4.11,-1.34,-3.451048816653214
CN(C(=O)c1cc(Br)c[nH]1)c1ccc(C(N)=O)cc1,C48832367_decoy,WEE1,Decoy,0.0,-6.63326,-7.32,-0.82,-6.758463358159084
[NH2+]=C1[C@@H](c2cc(Cl)c3c(c2)OCCCO3)[NH+]=CN1C1CC1,C50122289_decoy,WEE1,Decoy,0.0,-7.2581,-8.11,0.06,-7.079476843909523
Cc1n[nH]c2c1[C@@H](c1c(F)c(F)c(F)c(F)c1F)C(C#N)=C(N)O2,C04095177_decoy,WEE1,Decoy,0.0,-7.86442,-9.86,-0.4,-8.44179374091689
Nc1nc2n(n1)[C@H](c1ccc(F)cc1)C[C@H](c1ccccc1)N2,C00528143_decoy,WEE1,Decoy,0.0,-6.62747,-5.15,-0.12,-3.4013240304391466
Cc1ccc(NC(=O)c2cc(Br)cnc2N)nc1,C50696124_decoy,WEE1,Decoy,0.0,-7.37905,-8.27,-0.42,-7.588960827095135
C=CCN1C=[NH+][C@H](c2cc(Br)c3c(c2)OCCO3)C1=[NH2+],C50987589_decoy,WEE1,Decoy,0.0,-7.81124,-6.92,-0.57,-6.014891317915983
NNc1cc(C(=O)N2CC[C@@H]3CCCC[C@@H]3C2)cc(Cl)n1,C51090836_decoy,WEE1,Decoy,0.0,-7.62133,-7.23,-1.21,-7.510840701098719
Nc1ccc(S(=O)(=O)N[C@@H]2CCCc3ccccc32)cn1,C51634165_decoy,WEE1,Decoy,0.0,-7.29373,-9.07,-1.68,-8.317817816064125
CC1=C(C)[C@@H](c2nc3cc4c(cc3[nH]2)OCCO4)[C@H](N)S1,C39575061_decoy,WEE1,Decoy,0.0,-9.42114,-4.52,0.11,-3.17781042459543
C[C@H]1CN(c2ccc(Cl)cc2/C(N)=N/O)CC(C)(C)O1,C52860709_decoy,WEE1,Decoy,0.0,-8.74709,-4.73,-1.24,-4.175789640277027
Nc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c[nH+]1,C50654115_decoy,WEE1,Decoy,0.0,-8.26537,-8.48,-0.41,-7.9058716934714015
O=C(NNC(=O)c1ccc(F)cc1)N[C@H]1CCc2ccccc21,C09732811_decoy,WEE1,Decoy,0.0,-6.43592,-9.26,-1.73,-7.746218773286298
Nc1nc(Cc2nc3ncc(Br)cc3[nH]2)cs1,C43460825_decoy,WEE1,Decoy,0.0,-8.76021,-7.0,0.16,-15.153501941860776
CCCc1n[nH]c2c1[C@@H](c1ccccc1F)C(C#N)=C(N)O2,C04453458_decoy,WEE1,Decoy,0.0,-7.04609,-8.66,-0.33,-8.018690384916917
CC(C)n1cc(NC(=O)c2cc3cc(N)ccc3s2)cn1,C61682292_decoy,WEE1,Decoy,0.0,-8.81892,-8.45,-0.04,-8.112993400502813
OC1=C(C2=[NH+]CCN2)CCC/C1=C\c1ccc2c(c1)OCO2,C62716108_decoy,WEE1,Decoy,0.0,-8.03806,-7.67,-0.94,-5.807183349587148
Nc1nc2n(n1)[C@@H](c1cccs1)C[C@H](c1ccccc1)N2,C13123912_decoy,WEE1,Decoy,0.0,-8.78138,-7.39,-0.12,-6.5394546620547445
Nc1nc2n(n1)[C@@H](c1ccccc1)C[C@@H](c1ccc(F)cc1)N2,C13131382_decoy,WEE1,Decoy,0.0,-7.9547,-7.92,-0.66,-11.591775793826743
NNc1ccc(S(=O)(=O)N2CCC3(CCCC3)CC2)cc1,C62960040_decoy,WEE1,Decoy,0.0,-7.88001,-8.89,-0.21,-7.99570315815226
Cc1cc(Br)ccc1Oc1ccc(/C(N)=N/O)cn1,C63062011_decoy,WEE1,Decoy,0.0,-7.21443,-8.34,-0.52,-7.272525841694448
O=C(NNC(=O)c1cc(F)c(F)cc1Cl)NC1CCCC1,C65920996_decoy,WEE1,Decoy,0.0,-6.78977,-8.3,-4.63,-6.569275781254782
O[C@]1(CNc2ncnc3[nH]ccc23)CCCc2ccccc21,C66859927_decoy,WEE1,Decoy,0.0,-7.94111,-6.36,-0.96,-6.576494220894448
Cc1ccsc1C(=O)NNC(=O)NCC#Cc1ccccc1,C67042639_decoy,WEE1,Decoy,0.0,-7.68019,-7.21,-3.41,-6.5184837792730335
Nc1c(Cl)cc(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1Cl,C29540713_decoy,WEE1,Decoy,0.0,-8.68222,-9.15,-1.06,-7.800694644408865
O=C(NNC(=O)c1cc2sccc2[nH]1)NC1CCCCC1,C04966914_decoy,WEE1,Decoy,0.0,-8.1254,-8.15,-0.18,-7.831778998311158
Cc1cccn2cc(CSc3nc(N)cc(N)n3)nc12,C08705907_decoy,WEE1,Decoy,0.0,-6.55694,-8.6,-0.51,-7.024601976667396
Nc1cc(N)nc(SCc2nc3ccccc3s2)n1,C06831837_decoy,WEE1,Decoy,0.0,-9.5182,-6.73,-1.43,-7.742602811519571
Nc1ccc2nc(NC(=O)NC3CCCCC3)sc2c1,C22218654_decoy,WEE1,Decoy,0.0,-7.80348,-8.29,0.35,-9.672880506847736
Cc1ccc([C@@H]2C(C#N)=C(N)Oc3nc(N)sc32)cc1,C27825393_decoy,WEE1,Decoy,0.0,-7.3933,-9.59,0.11,-6.556658514757308
Nc1cc2c(cc1NC(=O)Nc1cccc(Cl)c1)OCO2,C36743848_decoy,WEE1,Decoy,0.0,-7.50062,-9.05,-2.68,-7.674858307196915
N/C(=N\O)c1cccc(C(=O)Nc2ccc(F)cc2Br)c1,C37342581_decoy,WEE1,Decoy,0.0,-7.51179,-10.31,-0.01,-8.128147016137332
Cc1ccc2nc([N-]S(=O)(=O)c3c[nH+][nH]c3N)sc2c1,C37558167_decoy,WEE1,Decoy,0.0,-8.00642,-5.0,-0.4,-4.078242849931447
N#C/C(=C\c1ccc(O)c(O)c1)C(=O)c1ccc(O)c(O)c1,C03871438_decoy,WEE1,Decoy,0.0,-9.77154,-9.74,-1.46,-8.731007816870834
CN(c1cc(N)cc(S(N)(=O)=O)c1)C1CCCCCC1,C37934297_decoy,WEE1,Decoy,0.0,-8.18398,-8.27,-0.17,-8.774526637081259
Cc1ccc(NC(=O)NC(C)(C)C)cc1S(N)(=O)=O,C40214972_decoy,WEE1,Decoy,0.0,-6.975,-4.41,-1.32,-5.055729871353336
CC(C)NC(=O)Nc1ccc(S(N)(=O)=O)cc1Br,C40220895_decoy,WEE1,Decoy,0.0,-7.08766,-8.68,-1.27,-7.280461526444209
Nc1n[nH]cc1S(=O)(=O)Nc1ccc2ccccc2c1,C40316850_decoy,WEE1,Decoy,0.0,-6.06131,-7.48,-0.37,-5.906549730554225
N/C(=N/O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1,C40367410_decoy,WEE1,Decoy,0.0,-7.09157,-10.49,-2.97,-8.417812982401577
Nc1ccc(-c2nnnn2C2CCCCCCC2)c(N)c1,C42015106_decoy,WEE1,Decoy,0.0,-6.72575,-7.99,-1.45,-6.488754209306348
Cc1ccc(F)cc1-n1nnnc1-c1cc(N)cc(N)c1,C42026690_decoy,WEE1,Decoy,0.0,-7.19407,-9.51,-1.57,-7.492012824149402
NC(=S)c1cccc(Cn2cnc3c(N)ncnc32)c1,C43461221_decoy,WEE1,Decoy,0.0,-7.51436,-8.18,-1.42,-7.42253129462219
Cc1cc([C@H](C)Nc2cc3c(cc2N)CC(=O)N3)c(C)o1,C44729768_decoy,WEE1,Decoy,0.0,-7.76993,-7.7,-1.65,-8.352815304631825
N/C(=N/O)C1(C(=O)Nc2ccc3c(c2)CCC3)CCCC1,C44784130_decoy,WEE1,Decoy,0.0,-8.04965,-10.05,-0.67,-11.986883862603408
C[C@@H]1[C@H](C)CCC[C@H]1NC(=O)C1(/C(N)=N/O)CCOCC1,C44784298_decoy,WEE1,Decoy,0.0,-7.93391,-4.46,-1.84,-4.320935685525142
CC1CCC(NC(=O)C2(/C(N)=N/O)CCCCCC2)CC1,C44784609_decoy,WEE1,Decoy,0.0,-7.74392,-4.96,-2.15,-5.82868789106813
Nc1cc(N2CCC[C@H]2C2CCCC2)cc(S(N)(=O)=O)c1,C45071634_decoy,WEE1,Decoy,0.0,-8.75406,-8.65,-1.02,-7.947406473416155
[NH3+][C@@H]1CCCN(C(=O)Nc2cc(Br)ccc2C(=O)[O-])C1,C48837297_decoy,WEE1,Decoy,0.0,-6.69933,-5.32,-1.09,-4.142382327319654
CN(C(=O)N[C@H]1CCCC[C@@H]1[NH3+])c1ccccc1C(=O)[O-],C48844186_decoy,WEE1,Decoy,0.0,-6.542,-7.96,-1.54,-8.268886127441855
CC[C@H]1CCCC[C@@H]1n1nnnc1-c1cc(N)cc(N)c1,C49122199_decoy,WEE1,Decoy,0.0,-7.60759,-9.09,-1.84,-9.640409534189434
Nc1ccc2n[nH]c(C(=O)Nc3nc4c(s3)CCC4)c2c1,C49540763_decoy,WEE1,Decoy,0.0,-8.72947,-8.97,0.05,-8.093201088569005
Nc1n[nH]cc1S(=O)(=O)/N=c1\[nH]c2c(s1)CCC2,C49541798_decoy,WEE1,Decoy,0.0,-7.33162,-6.64,-1.77,-6.114263969224664
Nc1cc(=O)[nH]c(SCc2ccc(C#CCO)cc2)n1,C49623811_decoy,WEE1,Decoy,0.0,-8.10695,-5.92,-0.91,-7.352101780154791
Cc1ccc2nc(NC(=O)c3n[nH]c(C)c3N)sc2c1,C50305444_decoy,WEE1,Decoy,0.0,-6.94642,-9.05,0.33,-7.276517469864662
Cc1cc(C)c(NC(=O)c2n[nH]c(C(C)C)c2N)c(C)c1,C50309726_decoy,WEE1,Decoy,0.0,-6.94244,-7.46,-1.3,-11.887303116333678
N/C(=N/O)C1(NC(=O)c2ccc3c(c2)CCO3)CCCC1,C50892606_decoy,WEE1,Decoy,0.0,-7.24549,-8.68,-0.26,-8.783126443373831
NNc1ccc(Cl)cc1C(=O)Nc1ccc2c(c1)OCO2,C51088571_decoy,WEE1,Decoy,0.0,-7.95516,-7.07,-1.08,-7.752230450497215
NNc1cccc(C(=O)Nc2ccc(Br)cc2F)n1,C51090096_decoy,WEE1,Decoy,0.0,-7.7089,-8.93,-1.42,-7.706978890437868
NNc1nc(C(=O)/N=c2\[nH]ccs2)cc2ccccc12,C51095314_decoy,WEE1,Decoy,0.0,-6.97397,-7.87,-1.04,-6.746125465737504
C[C@H]1CCN(c2ccc(S(N)(=O)=O)cc2N)[C@H](C)C1,C51730211_decoy,WEE1,Decoy,0.0,-8.41544,-8.0,-1.75,-8.792189944006234
Nc1cc(Br)ccc1S(=O)(=O)N[C@@H]1CCCC[C@H]1O,C51994043_decoy,WEE1,Decoy,0.0,-7.98401,-7.79,-2.18,-7.11168137085638
C[C@H]1CCC[C@](CO)(Nc2cc3c(cc2N)OCCO3)C1,C53114657_decoy,WEE1,Decoy,0.0,-7.5318,-8.67,-0.3,-12.196350688537064
CCC(=O)N1CCc2cc(-c3csc(N=C(N)N)n3)ccc21,C19499176_decoy,WEE1,Decoy,0.0,-7.19731,-6.64,-0.04,-8.34410777496934
O=C(Nc1cn[nH]c1)NC1[C@@H]2CCC[C@H]1C[NH+](C1CC1)C2,C56813690_decoy,WEE1,Decoy,0.0,-6.07091,-4.39,-0.13,-4.006169887471742
Cc1ccccc1[C@H]1C(C(N)=O)=C(N)OC2=C1C(=O)CC(C)(C)C2,C58949987_decoy,WEE1,Decoy,0.0,-7.09871,-6.23,-0.24,-4.178037242179316
Nc1ccc2oc(Cc3ccc4nc(N)sc4c3)nc2c1,C59116044_decoy,WEE1,Decoy,0.0,-9.94912,-9.34,-1.35,-8.262706635675308
CNC(=O)c1ccc(NC(=O)c2ccc(F)cc2N)cc1,C59931891_decoy,WEE1,Decoy,0.0,-6.2205,-8.95,-0.71,-11.200924590109093
Cc1cc(-n2nnnc2-c2cc(N)cc(N)c2)ccc1F,C61122208_decoy,WEE1,Decoy,0.0,-6.61548,-9.29,-0.47,-7.190663552273559
N/C(=N/O)[C@H]1CCC[C@@H]1NC(=O)c1ccc(Br)o1,C61886227_decoy,WEE1,Decoy,0.0,-7.73881,-7.27,-0.8,-8.160167562651877
N/C(=N/O)[C@@H]1CCC[C@H]1NC(=O)c1ccc(Br)cc1,C61886369_decoy,WEE1,Decoy,0.0,-7.69054,-8.64,-1.24,-8.360912691748307
N/C(=N/O)C1(NC(=O)[C@H]2CCCOC2)CCCCCC1,C62243120_decoy,WEE1,Decoy,0.0,-7.02541,-4.59,-0.56,-4.682427331781959
Cc1cc(C(=O)Nc2ccc3c(c2)OCO3)ccc1NN,C63058670_decoy,WEE1,Decoy,0.0,-7.51082,-10.02,-0.05,-8.237457509172739
CC1CCC(CNc2cc3c(cc2N)OCC(=O)N3)CC1,C63145082_decoy,WEE1,Decoy,0.0,-7.40211,-8.75,-0.68,-6.816452722051161
O=c1[nH]c(=S)[nH]c([O-])c1[C@@H]1NCCC2=c3cc(Cl)ccc3=[NH+][C@@H]21,C63386366_decoy,WEE1,Decoy,0.0,-7.72468,-4.96,-1.25,-3.3840243871267512
O=c1[nH]c(=S)[nH]c([O-])c1[C@H]1NCCC2=c3cc(Cl)ccc3=[NH+][C@H]21,C63386371_decoy,WEE1,Decoy,0.0,-7.53558,-4.95,-1.27,-3.921810034756895
Cc1sc(NC(=O)c2ccc(Cl)cc2)c(C(N)=O)c1C,C00493301_decoy,WEE1,Decoy,0.0,-8.07426,-8.51,-0.67,-8.362727277176791
C[C@@H]1CCc2c(sc(NC(=O)C3CCCC3)c2C(N)=O)C1,C02749050_decoy,WEE1,Decoy,0.0,-8.96601,-9.3,0.04,-9.377757386380036
Cc1ccc(C2=NN(C(N)=S)[C@](O)(C(F)(F)F)C2)cc1,C00192786_decoy,WEE1,Decoy,0.0,-7.23478,-7.57,-1.16,-8.35110882894199
NC(=S)N1N=C(c2ccc(Cl)cc2)C[C@]1(O)C(F)(F)F,C04476910_decoy,WEE1,Decoy,0.0,-7.9946,-5.32,-0.6,-4.435717700957484
C[C@@H]1CCc2c(C(=O)Nc3sccc3C(N)=O)csc2C1,C08733841_decoy,WEE1,Decoy,0.0,-9.85708,-6.93,-1.64,-8.297073401834881
Cc1cc(C)cc(NS(=O)(=O)c2cc(N)cc(C)c2C)c1,C20549106_decoy,WEE1,Decoy,0.0,-7.44024,-7.23,-2.87,-7.190672383825651
Cc1cc(N)cc(S(=O)(=O)Nc2ccc(F)cc2F)c1C,C20560374_decoy,WEE1,Decoy,0.0,-6.85239,-4.59,-2.49,-4.343517683792442
Nc1ccc2nc(NC(=O)c3cc(F)ccc3F)sc2c1,C21032163_decoy,WEE1,Decoy,0.0,-7.5035,-9.58,0.03,-7.03913866655745
Nc1cc(S(=O)(=O)Nc2ccc(F)cc2F)ccc1F,C21520315_decoy,WEE1,Decoy,0.0,-6.20336,-8.32,-4.13,-6.354835880510407
Cc1ccc(NS(=O)(=O)c2cc(C)c(C)c(N)c2)cc1C,C21520850_decoy,WEE1,Decoy,0.0,-7.59108,-9.49,-2.12,-7.638792546018449
Cc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2F)cc1N,C21809162_decoy,WEE1,Decoy,0.0,-7.07377,-9.12,-1.59,-7.915141401050883
C[C@@]12CC[C@H]3c4ccc(O)cc4CC[C@@H]3[C@H]1C/C(=N/O)[C@H]2O,C17020887_decoy,WEE1,Decoy,0.0,-9.40781,-5.6,-0.22,-2.9162442361361425
NS(=O)(=O)c1ccc(N[C@@H]2C[C@H]3C[C@@H]2[C@H]2CCC[C@H]32)cc1,C35624430_decoy,WEE1,Decoy,0.0,-9.04406,-5.3,-1.17,-5.060330375157148
Nc1cc2c(cc1Sc1cc(F)ccc1F)NC(=O)CO2,C35676159_decoy,WEE1,Decoy,0.0,-6.71314,-8.86,-0.76,-6.727176580284314
[H]/N=C1/SC(N)=C(C#N)[C@H](c2ccc(Cl)cc2Cl)[C@@H]1C#N,C03997137_decoy,WEE1,Decoy,0.0,-7.01743,-4.52,-1.48,-3.801755373661656
CCn1cc(N)cc1C(=O)Nc1ccccc1Br,C36861250_decoy,WEE1,Decoy,0.0,-7.75951,-7.41,-0.96,-7.276549507440234
Nc1cc(C(=O)Nc2ccc(Br)cc2)n(C2CC2)c1,C36861257_decoy,WEE1,Decoy,0.0,-7.95712,-4.33,-1.39,-4.889384638606616
Nc1cc(C(=O)Nc2cccc(Br)c2)n(C2CC2)c1,C36861263_decoy,WEE1,Decoy,0.0,-7.71251,-4.68,-0.67,-5.083734627651264
Nc1nc(SCc2ccc(F)cc2Br)n[nH]1,C14078445_decoy,WEE1,Decoy,0.0,-7.73613,-4.1,-0.69,-3.298206035091089
NS(=O)(=O)c1ccc(Cl)c(NC2CCSCC2)c1,C37138294_decoy,WEE1,Decoy,0.0,-9.33127,-8.27,-1.42,-8.466911382881529
NS(=O)(=O)c1cccc(N[C@H]2CCc3ccccc3C2)c1,C37201061_decoy,WEE1,Decoy,0.0,-8.44802,-5.62,-3.26,-3.4602877630802853
C[C@@H]1CCC[C@@H](NS(=O)(=O)c2cc(N)cc(Cl)c2F)C1,C37254432_decoy,WEE1,Decoy,0.0,-8.10054,-7.91,-1.58,-7.504449150128797
C[C@@H]1[C@H](C)CCC[C@@H]1NS(=O)(=O)c1c(F)cc(N)cc1F,C37928302_decoy,WEE1,Decoy,0.0,-7.12337,-7.85,-0.99,-6.9114688535472
C[C@@H]1[C@H](C)CCC[C@H]1NS(=O)(=O)c1cc(F)ccc1N,C37928985_decoy,WEE1,Decoy,0.0,-7.23272,-7.69,-3.23,-5.472333629488258
NS(=O)(=O)Nc1ccc2cc(Br)ccc2c1,C39121642_decoy,WEE1,Decoy,0.0,-8.09509,-9.12,-0.52,-7.390332957012911
NC(=O)c1cc(NC(=O)c2ccc(Br)s2)c(F)cc1F,C40232071_decoy,WEE1,Decoy,0.0,-8.81734,-8.01,-0.83,-7.592606719577007
C[C@H](NC(=O)c1cc(N)c(Cl)c(Cl)c1)[C@@H]1CCCO1,C40303719_decoy,WEE1,Decoy,0.0,-7.33601,-6.25,-1.25,-6.90707063776887
C[C@@H](NC(=O)c1ccc(Br)c(N)c1)c1ccco1,C40303825_decoy,WEE1,Decoy,0.0,-7.19644,-8.19,-1.35,-9.9911724339817
Cc1ccc([C@H](C)NC(=O)c2ccc(Br)c(N)c2)o1,C40345980_decoy,WEE1,Decoy,0.0,-7.29932,-7.56,-2.78,-9.206598322643952
Nc1ccc(C(=O)N2CCC[C@@H]2c2c[nH]c3cc(Cl)ccc23)cc1,C40820321_decoy,WEE1,Decoy,0.0,-7.23173,-9.07,-1.78,-8.173177164715536
CC(C)(Nc1nc2cc(Br)ccc2s1)C(N)=O,C45108677_decoy,WEE1,Decoy,0.0,-7.63561,-7.93,0.26,-11.825117100492722
CC1(C)C[C@@H]1NS(=O)(=O)c1c(N)cc(Cl)cc1Cl,C45116489_decoy,WEE1,Decoy,0.0,-7.36346,-7.76,-0.96,-7.674164266835373
CO[C@@H]1CCC[C@@H]1NC(=O)c1cc(N)c(Cl)c(Cl)c1,C50367438_decoy,WEE1,Decoy,0.0,-7.82699,-5.25,-1.01,-4.461932671753387
CO[C@H]1CCC[C@@H]1NC(=O)c1cc(N)c(Cl)c(Cl)c1,C50367440_decoy,WEE1,Decoy,0.0,-8.14978,-6.46,-0.25,-7.873592660288291
Nc1cc[nH+]c(/C([O-])=N/c2cc(C(F)(F)F)ccc2Cl)c1,C50693561_decoy,WEE1,Decoy,0.0,-7.1777,-5.13,-0.61,-4.0002169840406
Nc1cc[nH+]c(/C([O-])=N/c2ccc(Cl)cc2C(F)(F)F)c1,C50695224_decoy,WEE1,Decoy,0.0,-7.02005,-4.94,-1.46,-4.008465509705948
Cc1cc([C@@H](C)NC(=O)c2cc(N)nc(Cl)c2)c(C)s1,C50708256_decoy,WEE1,Decoy,0.0,-8.54462,-7.72,-1.19,-9.328684270243652
C#CCN1C(=[NH2+])[C@@H](c2cc(Br)ccc2OC)[NH+]=C1C,C50987905_decoy,WEE1,Decoy,0.0,-6.66539,-7.1,-3.07,-6.971330571993227
NS(=O)(=O)c1ccccc1N[C@@H]1CCc2ccccc2C1,C51632525_decoy,WEE1,Decoy,0.0,-8.20261,-7.72,-1.5,-6.548779515762163
Cc1cc(Br)ccc1-n1c([C@@H](C)O)nc2cc(N)ccc21,C53735982_decoy,WEE1,Decoy,0.0,-9.23345,-4.61,-0.34,-4.814791380337842
Cc1cc(Br)ccc1-n1c([C@H](C)O)nc2cc(N)ccc21,C53735984_decoy,WEE1,Decoy,0.0,-6.78063,-4.79,-0.66,-4.421489902364668
C[C@@H]1CCC[C@H](Sc2nc3c(cc2/C(N)=N/O)CCC3)C1,C54691218_decoy,WEE1,Decoy,0.0,-9.39969,-7.9,-1.51,-8.16084041477692
C[C@@H]1CCC[C@@H](Sc2nc3c(cc2/C(N)=N/O)CCC3)C1,C54691222_decoy,WEE1,Decoy,0.0,-9.93802,-7.89,-0.76,-8.22233454638808
C[C@H](NC(=O)c1csc(N)n1)c1ccc(Br)cc1,C55188744_decoy,WEE1,Decoy,0.0,-7.5633,-8.02,-0.64,-7.888539552743417
Nc1cc(F)ccc1S(=O)(=O)Nc1cc(F)c(F)cc1F,C61093323_decoy,WEE1,Decoy,0.0,-6.68823,-7.2,-1.11,-6.3822816164801335
CNC(=O)Nc1ccc(N[C@@H]2CCCc3sccc32)cc1,C61327821_decoy,WEE1,Decoy,0.0,-8.34133,-6.23,-0.73,-6.364504259614631
Cc1cc(C)cc(N(C)c2ccc(/C(N)=N/O)c(Cl)c2)c1,C61856106_decoy,WEE1,Decoy,0.0,-8.26559,-10.02,-0.67,-10.549561922969236
Nc1c(-c2nc3ccccc3s2)c(O)cn1C1CCCC1,C05010614_decoy,WEE1,Decoy,0.0,-9.59318,-8.87,-1.52,-8.319593935659368
N/C(=N/O)c1ccc(N2CCC3(CCCC3)CC2)c(Cl)c1,C62954207_decoy,WEE1,Decoy,0.0,-7.498,-5.87,-1.43,-4.916541754810259
O=C(Nc1ccccc1)NC1[C@@H]2CCC[C@H]1C[NH+](C1CC1)C2,C55084881_decoy,WEE1,Decoy,0.0,-6.06061,-4.7,-1.98,-3.9420389277435617
COc1ccc(N2CC[NH+]([C@H](c3cccs3)[C@H](C)NS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1,C09382675_decoy,WEE1,Decoy,0.0,-9.15208,-8.12,-1.75,-7.627101402433463
COc1ccc(N2CC[NH+]([C@@H](c3cccs3)[C@H](C)NS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1,C09382677_decoy,WEE1,Decoy,0.0,-9.72331,-8.01,-3.33,-7.773749037527327
COC(=O)c1c(NC(=O)CCSc2ccc(OC)cc2)sc2c1CC[NH+](Cc1ccccc1)C2,C10031261_decoy,WEE1,Decoy,0.0,-11.8092,-7.35,-3.69,-8.547292172211275
CC[C@]1(C2CC[NH+](C/C(C)=C/c3ccccc3)CC2)NC(=O)N(C[C@H]2COc3ccccc3O2)C1=O,C12038105_decoy,WEE1,Decoy,0.0,-9.04417,-8.32,-1.77,-7.614428214140104
C[C@H](NC(=O)CSc1nnc(C[NH+]2CCCC2)n1-c1ccccc1)c1ccc(-c2ccccc2)cc1,C12134975_decoy,WEE1,Decoy,0.0,-9.01452,-9.6,-2.43,-8.732084027292757
COc1ccc(CN(Cc2cc3cccc(C)c3[nH+]c2N2CCC[C@@H](O)C2)C(=O)c2ccc(C)cc2)cc1,C12453050_decoy,WEE1,Decoy,0.0,-8.7453,-9.95,-3.14,-9.85213640316047
C[C@H](c1nnc(SCC(=O)N[C@H](c2ccccc2)c2cccs2)n1-c1ccc(F)cc1)[NH+](C)C,C12515016_decoy,WEE1,Decoy,0.0,-9.12186,-8.41,-4.02,-9.128204718969371
Cc1ccccc1[C@@H](C)NC(=O)CSc1nnc([C@@H](C)[NH+]2CCCCC2)n1-c1ccc(F)cc1,C13075499_decoy,WEE1,Decoy,0.0,-7.89187,-8.45,-3.91,-7.037907303842507
CC(C)N(CCC(=O)NC1CC[NH+](Cc2ccccc2)CC1)c1nc(Cc2ccc(F)cc2)ns1,C16496276_decoy,WEE1,Decoy,0.0,-8.32912,-7.88,-3.8,-7.026691435534905
O=C(C[NH+]1CCN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1)Nc1ccccc1C(F)(F)F,C19600755_decoy,WEE1,Decoy,0.0,-8.80463,-6.26,-3.8,-6.076555914341735
CC[NH+]1CCC[C@H]1CNC(=O)c1ccc(/C=C2\Oc3ccccc3N(Cc3ccccc3F)C2=O)cc1,C20179257_decoy,WEE1,Decoy,0.0,-9.85956,-6.41,-2.14,-6.945841824768311
Cc1ccc(C[NH+]2CC[C@@H](CNS(=O)(=O)c3ccc(-c4cc(C(F)(F)F)on4)s3)C2)cc1,C20978075_decoy,WEE1,Decoy,0.0,-9.55486,-8.85,-3.26,-9.588585724858415
CCCCc1[nH]c(CN2CCc3c(cc(-c4ccncc4)c(=O)n3C/C=C/c3ccccc3)C2)c[nH+]1,C14740636_decoy,WEE1,Decoy,0.0,-8.54645,-8.54,-3.19,-8.098875277839058
C[C@H](NC(=O)CSc1nnc([C@@H](C)[NH+](C)C)n1-c1ccc(F)cc1)c1ccc(Cl)cc1Cl,C23483298_decoy,WEE1,Decoy,0.0,-9.43888,-8.31,-3.01,-8.236135918380604
CC(C)(C)[P@](=NC(=O)c1ccc([N+](=O)[O-])cc1)(Nc1cccc(C(F)(F)F)c1)c1cc[nH+]cc1,C12559781_decoy,WEE1,Decoy,0.0,-5.68443,-8.06,-2.69,-6.07154697503781
Cc1cccc(-c2noc(C[NH+]3CCC(C(=O)NCCCSCc4ccccc4F)CC3)n2)c1,C30975039_decoy,WEE1,Decoy,0.0,-9.83652,-9.67,-3.23,-9.889019059345104
Cc1ccc(-c2noc(C[NH+]3CCC(C(=O)NCCCSCc4ccc(F)cc4)CC3)n2)cc1,C30976460_decoy,WEE1,Decoy,0.0,-10.2176,-8.86,-3.4,-6.144931834106774
O=C(c1ccccc1)c1ccccc1NC(=O)C1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1,C30983042_decoy,WEE1,Decoy,0.0,-8.93358,-9.16,-1.94,-8.135009795058403
O=C(NCCCSCc1ccc(F)cc1)C1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1,C30983250_decoy,WEE1,Decoy,0.0,-9.72273,-9.63,-2.72,-8.535070337024113
CC1CCN(c2ccc([C@@H](C)NC(=O)C3CC[NH+](Cc4nc(-c5ccc(F)cc5)no4)CC3)cc2)CC1,C30983309_decoy,WEE1,Decoy,0.0,-8.86005,-9.3,-2.42,-7.274816270823133
CC[C@@H](NC(=O)[C@@H]1CCC[NH+](Cc2nc(-c3ccc(Br)cc3)no2)C1)c1ccc(C)c(C)c1,C31043992_decoy,WEE1,Decoy,0.0,-10.5106,-8.41,-3.8,-5.494818204947151
CC1CCN(c2ccc([C@@H](C)NC(=O)[C@H]3CCC[NH+](Cc4nc(-c5cccs5)no4)C3)cc2)CC1,C31057720_decoy,WEE1,Decoy,0.0,-9.49814,-8.1,-2.47,-6.975368395793304
C[C@@H]1CCCN(c2ccc([C@@H](C)NC(=O)[C@@H]3CCC[NH+](Cc4nc(-c5cccs5)no4)C3)cc2)C1,C31057745_decoy,WEE1,Decoy,0.0,-9.8682,-7.23,-2.65,-6.909664217782531
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)[NH+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1,C29851615_decoy,WEE1,Decoy,0.0,-6.79531,-7.57,-3.71,-4.992471957498339
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NC[C@H](c3cccs3)[NH+]3CCCC3)CC2)cc1,C32217754_decoy,WEE1,Decoy,0.0,-10.6745,-9.18,-3.69,-9.741662313591323
COc1ccc(C[NH+](Cc2ccccc2)Cc2ccc(C(=O)NCc3ccc(F)cc3)o2)cc1OC,C33689482_decoy,WEE1,Decoy,0.0,-8.36343,-8.86,-4.84,-8.224358130833568
COc1ccc([C@H]2C[NH+](Cc3ccc(OC)cc3O)C[C@H]2CN(Cc2ccc(F)cc2)C(C)=O)cc1,C34699372_decoy,WEE1,Decoy,0.0,-9.71729,-9.02,-2.98,-9.859222270764755
CC1(C)[C@H]2CC=C(CN(CC[NH+]3CCN(C(=O)Nc4ccccc4F)CC3)C(=O)c3ccco3)[C@@H]1C2,C34997623_decoy,WEE1,Decoy,0.0,-8.47949,-6.64,-3.81,-5.754420345468742
CC[C@H](NC(=O)c1ccc(OC)cc1)[C@H]1c2cc(OC)c(OC)cc2CC[NH+]1Cc1ccccc1C,C35674443_decoy,WEE1,Decoy,0.0,-8.22919,-6.28,-2.0,-6.908705832728397
CC[NH+](CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(C)cc1C)C[C@@H](O)COC(C)(C)C,C35778885_decoy,WEE1,Decoy,0.0,-8.95168,-6.31,-3.14,-6.828115931771637
CC[NH+]1CCN([C@@H](c2ccc(OC)cc2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)CC1,C38546567_decoy,WEE1,Decoy,0.0,-8.19112,-4.79,-4.08,-5.559096345963795
Cc1ccccc1CSCCCNC(=O)[C@H]1CCC[NH+](Cc2nc(-c3ccc(F)cc3)no2)C1,C38901585_decoy,WEE1,Decoy,0.0,-9.07207,-8.27,-4.39,-5.215372803384496
O=C(NCCSc1ccccc1)[C@H]1CCC[NH+](Cc2nc(-c3ccc(Br)cc3)no2)C1,C38905162_decoy,WEE1,Decoy,0.0,-10.2357,-9.08,-1.89,-8.529971786029602
COc1ccc([C@H](C)NC(=O)[C@H]2CCC[NH+](Cc3nc(-c4ccc(Br)cc4)no3)C2)cc1,C38905634_decoy,WEE1,Decoy,0.0,-9.19794,-9.5,-1.74,-10.628582795308429
Cc1ccc(S(=O)(=O)N(CCc2cccs2)CC(=O)N[C@H]2CC[NH+](Cc3ccccc3)C2)cc1,C39266804_decoy,WEE1,Decoy,0.0,-10.0408,-8.96,-2.8,-10.107383246859252
Cc1ccc(OC[C@H](O)C[NH+](Cc2ccc(-c3ccc(F)cc3)o2)[C@@H]2CCS(=O)(=O)C2)cc1C,C40315085_decoy,WEE1,Decoy,0.0,-8.79573,-8.84,-2.68,-7.664274890015481
O=C(NCc1ccccc1C(F)(F)F)C1CC[NH+](Cc2nc(-c3ccc(Cl)cc3)no2)CC1,C40930891_decoy,WEE1,Decoy,0.0,-7.34439,-9.73,-2.71,-6.710303909982402
COc1ccc(-c2nc(C[NH+]3CCC(C(=O)NCc4cccc(C(F)(F)F)c4)CC3)c(C)o2)cc1,C40984686_decoy,WEE1,Decoy,0.0,-9.02542,-10.23,-4.36,-10.405097202307957
CC[NH+]1CCN(CCNC(=O)c2ccc(-c3nc(CSc4ccc(C)cc4)c(C)o3)cc2)CC1,C22936584_decoy,WEE1,Decoy,0.0,-9.18261,-8.18,-1.68,-6.6946801922567545
O=C(N[C@H]1CCCC[C@@H]1OCc1ccccc1)[C@H]1CCCC[C@H]1C(=O)N1CCN(c2cccc[nH+]2)CC1,C44942892_decoy,WEE1,Decoy,0.0,-9.33102,-10.56,-3.26,-9.530726554263406
O=C(NCCC(c1ccccc1)c1ccccc1)[C@@H]1CC=CC[C@H]1C(=O)N1CCN(c2cccc[nH+]2)CC1,C38740791_decoy,WEE1,Decoy,0.0,-8.7998,-9.13,-2.1,-8.12731817092691
COc1ccc([C@H](NC(=O)[C@H](C)[NH+]2CCN(c3ccc(C(F)(F)F)cn3)CC2)c2ccccc2)cc1,C46560473_decoy,WEE1,Decoy,0.0,-9.33775,-7.79,-3.17,-7.016449835248581
COc1ccc([C@H](NC(=O)[C@@H](C)[NH+]2CCN(c3ccc(C(F)(F)F)cn3)CC2)c2ccccc2)cc1,C46560474_decoy,WEE1,Decoy,0.0,-8.35768,-9.68,-3.54,-8.85409869516759
O=S(=O)(NC[C@H](c1ccco1)[NH+]1CCN(c2ccc(F)cc2)CC1)c1ccc(Br)s1,C49486318_decoy,WEE1,Decoy,0.0,-10.5656,-5.03,-2.31,-5.39822388957455
CC[C@@H](C)[C@H]1[NH2+]C2(CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)N(Cc2ccc(F)cc2)C1=O,C36024453_decoy,WEE1,Decoy,0.0,-8.83289,-9.45,-3.23,-8.39160761583296
CC[C@H](C)CN1C(=O)[C@H](Cc2ccccc2)[NH2+]C12CCN(S(=O)(=O)c1cccc(Cl)c1)CC2,C36027399_decoy,WEE1,Decoy,0.0,-9.47176,-8.77,-3.62,-7.657153818823158
CC[NH+]1CCN(c2ccc(NC(=O)CSc3nnc(-c4ccc(Br)cc4)o3)cc2)CC1,C33432030_decoy,WEE1,Decoy,0.0,-9.56677,-8.0,-1.08,-7.361545334488491
Cc1ccc(-c2nnc(SCC(=O)Nc3cc(C(F)(F)F)ccc3N3CC[NH+](C)CC3)o2)cc1,C59212303_decoy,WEE1,Decoy,0.0,-8.13703,-9.57,-2.02,-8.221136336501914
CN(C)c1ccc([C@H](CNS(=O)(=O)c2ccc3c(c2)OCCCO3)C2=c3ccccc3=[NH+]C2)cc1,C63221858_decoy,WEE1,Decoy,0.0,-9.61834,-10.14,-1.73,-8.57923007630034
O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)O[C@H](C(=O)C1=c2ccccc2=[NH+]C1)c1ccccc1,C39945419_decoy,WEE1,Decoy,0.0,-10.297,-8.51,-1.33,-9.391814739489051
O=C(/C=C/c1ccc(Cl)cc1Cl)Nc1cccc(S(=O)(=O)NC2=[NH+]CCCCC2)c1,C08693968_decoy,WEE1,Decoy,0.0,-9.84787,-10.01,-2.07,-9.269726771793025
CC[C@H](C)[C@@H]([NH3+])C(=O)Oc1ccc2c(=O)c(Oc3ccc(Cl)cc3Cl)coc2c1,C02103053_decoy,WEE1,Decoy,0.0,-9.07404,-9.65,-0.44,-8.695262383924714
COc1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc(Cl)cc2)cc1OC,C09215853_decoy,WEE1,Decoy,0.0,-9.4299,-10.73,-2.63,-9.565313128519362
COc1ccc([C@H]2[C@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc(Cl)cc2)cc1OC,C09215856_decoy,WEE1,Decoy,0.0,-8.2303,-8.88,-2.72,-9.621704871971405
C=CCOc1ccccc1C[NH+]1C[C@@H](Sc2nc3ccccc3[nH]2)C[C@H]1C(=O)NC(C)C,C12151399_decoy,WEE1,Decoy,0.0,-9.75791,-6.37,-3.22,-6.214014601575789
Cc1ccc(C)c(CSC[C@H]2Nc3ccc(C(=O)N4CCN(c5cccc[nH+]5)CC4)cc3NC2=O)c1,C09505453_decoy,WEE1,Decoy,0.0,-9.28089,-8.23,-2.7,-8.994854376511293
C[C@@H]1C[NH+](CCOc2ccc(-c3n[nH]cc3-c3ccc(Br)cc3)c(O)c2)C[C@@H](C)O1,C09410831_decoy,WEE1,Decoy,0.0,-9.83373,-8.65,-0.81,-9.64884958634396
COc1ccc(CC(=O)Nc2ccc(N3CCC([NH2+][C@H]4CCOC(C)(C)C4)CC3)cc2)cc1,C14982919_decoy,WEE1,Decoy,0.0,-10.0911,-8.22,-1.54,-7.272242402907088
COc1cc([C@@H](Nc2cc(C)cc[nH+]2)c2ccc3cccnc3c2O)ccc1OCc1ccccc1,C15016414_decoy,WEE1,Decoy,0.0,-10.739,-8.93,-1.96,-8.521618520532563
Cn1c(=O)n(C)c2cc([C@H](O)COc3ccc(C[NH2+]C4C5CC6CC(C5)CC4C6)cc3)ccc21,C16363895_decoy,WEE1,Decoy,0.0,-8.67585,-9.88,-1.54,-8.411459590875282
CCN(c1ccc(NC(=O)C[NH+]2CCC(C(=O)NCc3ccccc3)CC2)cc1)C(C)C,C16396191_decoy,WEE1,Decoy,0.0,-7.00879,-7.93,-2.1,-5.769102810165594
O=[N+]([O-])c1ccc(NCC[NH2+]Cc2cc(Br)ccc2OCc2ccc(F)cc2)cc1,C16401803_decoy,WEE1,Decoy,0.0,-7.4643,-9.32,-2.53,-7.429835070710447
CCOc1cccc([C@H]2CC(c3ccc4c(c3)OCO4)=N[C@@H](c3ccc(C(F)(F)F)cc3)[NH2+]2)c1O,C20764095_decoy,WEE1,Decoy,0.0,-9.36674,-7.55,-2.28,-6.4989725677800605
CCOc1cccc([C@@H]2CC(c3ccc4c(c3)OCO4)=N[C@H](c3ccc(C(F)(F)F)cc3)[NH2+]2)c1O,C20764099_decoy,WEE1,Decoy,0.0,-9.32292,-7.02,-2.2,-5.348472120735666
C[C@H](C(=O)Nc1ccccc1Sc1ccccc1)N1CCC[NH+](CC(=O)NC(C)(C)C)CC1,C22790608_decoy,WEE1,Decoy,0.0,-8.73738,-7.2,-1.88,-8.077914188921204
O=C(C[NH+]1CCC(NS(=O)(=O)c2ccc(C3CCCCC3)cc2)CC1)Nc1ccccc1,C25143390_decoy,WEE1,Decoy,0.0,-8.31024,-7.99,-3.17,-7.112483204064803
Cc1ccc(C(=O)Nc2ccccc2NC(=O)OCC2CCN(c3cc[nH+]cc3)CC2)cc1,C28526626_decoy,WEE1,Decoy,0.0,-8.93068,-9.73,-2.35,-8.799004575203618
CC[NH+](CC)[C@@H](CNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2)ccc1C)C(C)C,C31382302_decoy,WEE1,Decoy,0.0,-8.3236,-7.64,-3.21,-7.756285939707893
CC[NH+](CC)Cc1cccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2)c1,C31589223_decoy,WEE1,Decoy,0.0,-9.16319,-9.6,-0.77,-8.570131358063453
Cc1ccsc1C[NH+](CCc1c[nH]c2ccccc12)Cc1nc(C(=O)N[C@H](C)c2ccccc2)co1,C36073604_decoy,WEE1,Decoy,0.0,-8.37131,-8.49,-3.07,-7.907159225846782
CCOC[C@@H](O)C[NH2+][C@@H](Cc1ccccc1)c1nc(-c2ccc(Br)cc2)no1,C36160222_decoy,WEE1,Decoy,0.0,-8.70825,-8.15,-3.01,-7.884205616951383
C=CCOC[C@@H](O)C[NH+](Cc1nc2sc3c(c2c(=O)[nH]1)CC[C@H](C)C3)C1CCCCC1,C36161521_decoy,WEE1,Decoy,0.0,-10.6614,-8.27,-3.85,-9.159816273793366
COC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCc2[nH]c[nH+]c2[C@H]1c1cccc(F)c1F,C20745541_decoy,WEE1,Decoy,0.0,-9.37501,-7.91,-3.04,-8.608680676171376
CCc1cc([C@H](Nc2cccc[nH+]2)c2cccc(OC)c2OC)c(NC(=O)c2ccccc2)s1,C38547071_decoy,WEE1,Decoy,0.0,-9.33663,-5.3,-3.95,-6.124735326201912
CCc1cc([C@@H](Nc2cccc[nH+]2)c2ccc(OC(F)F)cc2)c(NC(=O)c2ccco2)s1,C38547894_decoy,WEE1,Decoy,0.0,-10.4168,-7.96,-4.47,-8.605834982308181
CCOc1ccccc1NC(=O)N[C@@H](C)[C@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1,C38597341_decoy,WEE1,Decoy,0.0,-8.54658,-5.45,-2.14,-6.630644368911314
CC(C)Cc1cc(S(=O)(=O)Oc2ccccc2)ccc1N1CC[NH2+][C@@H](c2ccccc2O)C1,C39529518_decoy,WEE1,Decoy,0.0,-8.05413,-8.96,-2.88,-10.310438966731084
CC(C)[NH+]1C[C@H](NCc2cccc(C(F)(F)F)c2)C[C@H]1C(=O)NCCc1ccc2c(c1)OCO2,C39552202_decoy,WEE1,Decoy,0.0,-8.47834,-9.13,-3.42,-8.67443080776144
CCOc1ccccc1CCNC(=O)[C@H]1CN(C(=O)[C@@H](CC)c2ccccc2)CC12CC[NH2+]CC2,C39652722_decoy,WEE1,Decoy,0.0,-8.78789,-7.99,-3.43,-10.269197386385358
CCc1ccc(CCNC(=O)[C@H]2CN(C(=O)[C@@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)cc1,C39654604_decoy,WEE1,Decoy,0.0,-8.91823,-10.49,-4.46,-9.369739221243806
CCCCCCC(=O)N1C[C@H](C(=O)NC[C@@H](C)Oc2ccc(C)cc2)C2(CC[NH2+]CC2)C1,C39666152_decoy,WEE1,Decoy,0.0,-8.80939,-7.31,-3.94,-6.354139497633755
CCCCCCC(=O)N1C[C@@H](C(=O)NC[C@H](C)Oc2ccc(C)cc2)C2(CC[NH2+]CC2)C1,C39666155_decoy,WEE1,Decoy,0.0,-7.58907,-6.61,-4.5,-4.079456952532828
CCCC[C@H](C)C(=O)N1C[C@@H](C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C2(CC[NH2+]CC2)C1,C39675425_decoy,WEE1,Decoy,0.0,-8.7027,-8.27,-3.29,-10.002834971496592
CCCCCCC(=O)N1C[C@H](C(=O)N[C@H](C)Cc2ccccc2OC)C2(CC[NH2+]CC2)C1,C39686624_decoy,WEE1,Decoy,0.0,-8.1905,-8.07,-4.25,-4.979507970586912
C[NH+](Cc1ccccc1NC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1)C1CCCCC1,C40051509_decoy,WEE1,Decoy,0.0,-9.24274,-10.96,-1.69,-10.760968023774655
CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1,C40156281_decoy,WEE1,Decoy,0.0,-9.01188,-8.49,-3.8,-8.550103749631747
CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1,C40156282_decoy,WEE1,Decoy,0.0,-9.79171,-9.09,-1.98,-9.370365570266143
CC(C)[C@H](O)C[NH+]1CCCN(c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2)CC1,C40415941_decoy,WEE1,Decoy,0.0,-8.56806,-9.09,-2.39,-10.96185416995996
COc1ccc(-c2cc([C@H]3C[NH+]4CC[C@@H]3C[C@@H]4CNC(=S)NCC(C)C)n(C)n2)cc1,C43525590_decoy,WEE1,Decoy,0.0,-8.73547,-7.18,-3.92,-6.241836445118121
Cc1ccc(NC(=O)C[C@@H]2C(=O)Nc3ccccc3N2C(=O)C[NH+](C)C2CCCCC2)cc1,C45866103_decoy,WEE1,Decoy,0.0,-7.34384,-6.15,-3.68,-4.707425925748744
Cc1ccc(NC(=O)C[C@H]2C(=O)Nc3ccccc3N2C(=O)C[NH+](C)C2CCCCC2)cc1,C45866104_decoy,WEE1,Decoy,0.0,-8.27038,-7.64,-2.56,-7.875494681472506
COc1cc(/C=N/c2ccc3cc4ccc(/N=C/c5ccc(O)c(OC)c5)cc4[nH+]c3c2)ccc1O,C12576372_decoy,WEE1,Decoy,0.0,-10.1242,-7.14,-1.58,-6.332101958777141
COc1ccc(NC(=O)c2nnc(C[NH2+][C@@H](c3ccc(C(C)(C)C)cc3)C(C)C)s2)cc1,C60160282_decoy,WEE1,Decoy,0.0,-8.91632,-7.44,-4.35,-7.393053324641072
O=C(NC[C@H]1CCCN(C(=O)[C@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1)Nc1cccc(F)c1,C60369341_decoy,WEE1,Decoy,0.0,-9.09706,-8.91,-2.98,-7.158123223948009
O=C(NC[C@H]1CCCN(C(=O)[C@@H]2CCC[NH+](Cc3cccc(F)c3)C2)C1)Nc1cccc(F)c1,C60369342_decoy,WEE1,Decoy,0.0,-8.87734,-9.11,-1.55,-7.684066925460923
O=C(Nc1ccccc1O)C1CCN(C(=O)CCC2=c3ccccc3=[NH+][C@H]2c2ccc(F)cc2)CC1,C63182446_decoy,WEE1,Decoy,0.0,-9.01458,-10.35,-3.01,-7.246882325250318
O=C(CS[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)O1)Nc1cccc(Oc2ccccc2)c1,C39944453_decoy,WEE1,Decoy,0.0,-9.47978,-9.14,-1.47,-8.808886095959073
COc1ccc(N/C(=N\C(=O)c2cccc(C)c2)NCCC2=c3ccccc3=[NH+]C2)cc1Cl,C63589296_decoy,WEE1,Decoy,0.0,-8.42702,-10.26,-2.86,-8.800194978454865
CCC[C@H](C)NC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NS(=O)(=O)c1ccc(Cl)cc1,C64202137_decoy,WEE1,Decoy,0.0,-9.74712,-8.82,-2.95,-2.938876303396808
CCN(C(=O)c1ccc(NC(=O)C[NH2+]Cc2ccc(OC(C)C)cc2)cc1)c1ccccc1,C66109719_decoy,WEE1,Decoy,0.0,-7.81827,-7.64,-3.8,-6.903824364397952
CSc1cccc(NC(=O)O[C@@H]2CC[C@]3(C)[C@@H](CC[C@@H](O)[C@H]3CC(=O)N3CCC(C)CC3)[C@]2(C)CO)c1,C04236779_decoy,WEE1,Decoy,0.0,-9.56706,-9.37,-4.93,-6.328190380374936
Cc1ccc(-c2nc3ccccc3[nH]2)cc1NC(=S)NC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1,C08833361_decoy,WEE1,Decoy,0.0,-8.54851,-6.57,-1.95,-5.644500963869607
CC(C)(C)[C@H]1CCc2c(sc3ncn(CC(=O)Nc4sc5c(c4C(N)=O)CCCC5)c(=O)c23)C1,C08920040_decoy,WEE1,Decoy,0.0,-9.68563,-8.16,-5.82,-7.355021467474376
CC(=O)[C@H]1CC[C@H]2[C@H]3CCC4=C/C(=N\OCC(=O)NCCc5ccc(O)c(O)c5)CC[C@]4(C)[C@@H]3CC[C@]12C,C09045213_decoy,WEE1,Decoy,0.0,-11.0857,-8.81,-4.65,-5.911514405255928
COC(=O)c1c(NC(=O)c2c(N)n(-c3ccccc3)c3nc4ccccc4nc23)sc2c1CCCC2,C02315326_decoy,WEE1,Decoy,0.0,-10.4217,-6.42,-4.21,-7.030587194940363
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)Nc3cccc(NC(=O)c4ccco4)c3)c2)cc1F,C10549192_decoy,WEE1,Decoy,0.0,-8.66828,-9.6,-1.87,-7.436437236764173
Cc1cc(C)c(Nc2nnc(SCC(=O)N3C[C@H](C(N)=O)Oc4ccccc43)s2)c(Cl)c1,C11278175_decoy,WEE1,Decoy,0.0,-8.10184,-7.22,-2.43,-5.931218871961764
CON=C1CCCc2c(C(=O)NNC(=O)Nc3ccc(OC(F)(F)F)cc3)sc(SC)c21,C12367081_decoy,WEE1,Decoy,0.0,-9.3299,-9.04,-2.42,-10.793975614111554
O=C(NNc1ccnc2cc(Cl)ccc12)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccccc1,C05734061_decoy,WEE1,Decoy,0.0,-8.70321,-9.62,-1.94,-8.999506367713357
Cc1ccc(-c2nnc(SCC(=O)Nc3ccc(S(N)(=O)=O)cc3)n2-c2ccc(Cl)cc2)cc1,C02450070_decoy,WEE1,Decoy,0.0,-9.69426,-5.55,-2.38,-5.768162297906399
COc1ccc(C)cc1NC(=O)Nc1cc(C)c2nc(NS(=O)(=O)c3ccc(C)cc3)sc2c1,C13349230_decoy,WEE1,Decoy,0.0,-9.69108,-10.53,-2.98,-8.551034503411696
COc1cc(NC(=O)Nc2ccc3sc(NC(=O)C4CCCCC4)nc3c2)cc(OC)c1OC,C13353907_decoy,WEE1,Decoy,0.0,-8.83733,-9.17,-1.84,-7.792433760565169
O=C(NNC(=S)NC1CCCCC1)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1,C15874460_decoy,WEE1,Decoy,0.0,-10.5514,-8.59,-3.14,-8.266636651820926
Cc1cccc(Nc2ccccc2C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)c1C,C16752732_decoy,WEE1,Decoy,0.0,-9.01674,-10.62,-2.75,-8.67219330006098
CC(=O)[C@@H]1CC[C@@H]2[C@@H]3CCC4=C/C(=N\OCC(=O)NCCc5ccc(O)c(O)c5)CC[C@]4(C)[C@@H]3CC[C@@]21C,C17138841_decoy,WEE1,Decoy,0.0,-10.6007,-9.05,-3.6,-5.818371919323644
CC1=C(C(=O)Nc2c(C)cccc2C)[C@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2ccc(C)c(C)c2)N1,C12250174_decoy,WEE1,Decoy,0.0,-10.0086,-5.79,-3.11,-6.391043297034428
CC1=C(C(=O)Nc2cccc(C)c2)[C@@H](c2ccco2)C(C#N)=C(SCC(=O)Nc2cccc(F)c2)N1,C12250455_decoy,WEE1,Decoy,0.0,-8.03529,-5.61,-2.1,-5.207073148433228
CC(C)(C)[C@H]1CCc2nc3ccccc3c(C(=O)OCC(=O)Nc3cccc(S(N)(=O)=O)c3)c2C1,C20753137_decoy,WEE1,Decoy,0.0,-10.0061,-7.93,-1.2,-7.779858925357431
C/C(=N\Nc1nc(SCC(=O)N[C@H]2CCCc3ccccc32)n[nH]1)C12CC3CC(CC(C3)C1)C2,C20837387_decoy,WEE1,Decoy,0.0,-11.0227,-8.95,-2.35,-10.411846421970566
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)cc1,C21000865_decoy,WEE1,Decoy,0.0,-10.1575,-9.72,-2.59,-8.573065983946227
COc1cccc(Nc2nnc(S[C@H](C)C(=O)NC(=O)NC34CC5CC(CC(C5)C3)C4)s2)c1,C21399563_decoy,WEE1,Decoy,0.0,-9.76492,-8.1,-2.93,-8.663000508774209
Cc1ccc(C)c(-c2cc(NC(=O)CSc3nnc(-c4ccoc4C)n3N)n(-c3ccccc3)n2)c1,C22122709_decoy,WEE1,Decoy,0.0,-10.5439,-9.59,-1.84,-10.06580027332274
CCCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)NC(=O)Nc2ccc(Br)cc2)C1=O,C24094876_decoy,WEE1,Decoy,0.0,-7.9331,-8.04,-3.01,-7.360195352439502
O=C(NC(=S)Nc1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1)c1ccc2c(c1)OCO2,C32126266_decoy,WEE1,Decoy,0.0,-9.55647,-8.37,-3.58,-7.45959349172949
CCOC(=O)c1c(N)n(-c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)c2nc3ccccc3nc12,C06146128_decoy,WEE1,Decoy,0.0,-9.27521,-9.2,-2.62,-7.88247612609133
O=C(Nc1ccccc1)N[C@H](Cc1ccccc1)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C35303103_decoy,WEE1,Decoy,0.0,-9.39756,-7.39,-1.32,-7.244056725555982
CC[C@H](C)[C@H](NC(=O)Nc1cccc2ccccc12)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C35303136_decoy,WEE1,Decoy,0.0,-9.25734,-9.47,-4.25,-8.845753752364164
CC[C@H](C)[C@@H](NC(=O)Nc1cccc2ccccc12)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C35303144_decoy,WEE1,Decoy,0.0,-9.93021,-9.61,-3.97,-7.391401559987504
COc1ccc(-c2csc(C3=C(N)N(/N=C/c4cc(C(C)(C)C)c(O)c(C(C)(C)C)c4)CC3=O)n2)cc1,C35686400_decoy,WEE1,Decoy,0.0,-9.28027,-8.51,-4.05,-6.812219104226218
CCCN1C(=O)N[C@H](c2ccc(NC(=O)Nc3ccc(Br)cc3)cc2)C(C(=O)OC)=C1C,C35711910_decoy,WEE1,Decoy,0.0,-6.37506,-8.45,-2.4,-5.956033603901336
Cc1cccc(C)c1NC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C35729422_decoy,WEE1,Decoy,0.0,-9.3847,-7.78,-2.74,-7.069243051325627
CC[C@H](C)[C@H](NC(=O)Nc1ccc(F)cc1F)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C35729437_decoy,WEE1,Decoy,0.0,-8.83173,-7.04,-2.49,-6.601567910030371
CC(=O)[C@@H]1CC[C@H]2[C@H]3CCC4=C/C(=N\OCC(=O)NCCc5ccc(O)c(O)c5)CC[C@]4(C)[C@@H]3CC[C@]12C,C36602835_decoy,WEE1,Decoy,0.0,-11.1789,-7.03,-2.99,-6.829201506870983
COc1ccc(/C=C2\CCC[C@H]3C2=NN(C(=O)CSc2n[nH]c(N)n2)[C@H]3c2ccc(OC)cc2)cc1,C13865323_decoy,WEE1,Decoy,0.0,-9.76804,-8.88,-1.27,-8.648659488581151
COc1ccc([C@@H]2C[C@H](C(F)(F)F)N3NC(C(=O)Nc4cccc([C@H](C)O)c4)=C(Cl)C3=N2)cc1,C00866988_decoy,WEE1,Decoy,0.0,-9.99352,-6.39,-2.55,-6.4032551305019565
CC1=C[C@@H]([C@H]2N=N[C@H](SCC(=O)Nc3ccc(-c4nc5ccc(C)cc5s4)cc3)N2N)N=N1,C38984760_decoy,WEE1,Decoy,0.0,-9.95488,-9.13,-2.6,-7.216967098499557
Cc1oc2nc(SCC(=O)NC(=O)NC3CCCCC3)nc(NC(=O)c3ccccc3)c2c1C,C39553935_decoy,WEE1,Decoy,0.0,-10.3203,-8.44,-4.27,-8.887498516347902
Cc1ccc(C2=C[C@H]([C@@H]3N=N[C@H](SCC(=O)Nc4ccc(Cl)cc4C(F)(F)F)N3N)N=N2)cc1,C39592228_decoy,WEE1,Decoy,0.0,-9.92156,-8.48,-3.68,-9.110838511421248
C[C@@H]1C[C@@H]2[C@H]3CCC4=Cc5c(cnn5-c5ccc(Cl)nc5)C[C@]4(C)[C@@H]3[C@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,C40719026_decoy,WEE1,Decoy,0.0,-8.59568,-5.83,-3.28,-4.8762222060618345
Cc1ccccc1NC(=O)[C@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)Nc2ccccc2C)[C@@H]1c1ccc([N+](=O)[O-])cc1,C41006555_decoy,WEE1,Decoy,0.0,-8.4632,-6.13,-3.13,-6.371818695777927
CC(=O)Nc1cccc(Nc2nnc(SCC(=O)Nc3ccc4c(c3)OC3(CCCC3)O4)s2)c1,C46587840_decoy,WEE1,Decoy,0.0,-11.3798,-9.39,-1.83,-9.574317525147707
COc1ccc(-c2[nH]nc3c2[C@H](c2ccc(OC)c(OCc4ccccc4)c2)C(C#N)=C(N)O3)cc1,C39324902_decoy,WEE1,Decoy,0.0,-9.65073,-6.75,-1.66,-6.752959292362795
[NH2+]=C1[C@@H](C(=O)/N=c2\[nH]ccs2)[C@H](c2cccc([N+](=O)[O-])c2)C2=C(CCCC2=O)N1c1ccc(F)cc1,C51144767_decoy,WEE1,Decoy,0.0,-6.0406,-5.25,-4.84,-3.938538957404719
CC(C)Cc1ccc(-c2n[nH]c3c2[C@@H](c2ccccc2OC(=O)c2ccco2)C(C#N)=C(N)O3)cc1,C36618847_decoy,WEE1,Decoy,0.0,-6.85081,-6.34,-1.68,-4.2272574995842165
COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)cc(OC)c1OCc1ccc(F)cc1,C01129483_decoy,WEE1,Decoy,0.0,-9.64512,-8.89,-2.6,-10.955012278023077
COc1cc(-c2n[nH]c3c2[C@@H](c2ccc(-c4ccccc4)cc2)C(C#N)=C(N)O3)cc(OC)c1OC,C00846314_decoy,WEE1,Decoy,0.0,-8.5693,-6.2,-1.07,-6.088466271245717
O=C(CSc1n[nH]c(N/N=C/c2ccc(Br)cc2)n1)Nc1ccc(Br)cc1,C59015504_decoy,WEE1,Decoy,0.0,-9.52391,-7.77,-0.97,-8.111041625302958
CC1CCN(c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC[C@H](C(C)(C)C)C4)cc2[N+](=O)[O-])CC1,C59294462_decoy,WEE1,Decoy,0.0,-10.1289,-9.42,-2.97,-8.398135578112534
C/C(=N\Nc1nc(SCC(=O)Nc2sc3c(c2C#N)CCC3)n[nH]1)C12CC3CC(CC(C3)C1)C2,C59310739_decoy,WEE1,Decoy,0.0,-10.8903,-8.66,-2.31,-9.31835490589851
Cc1ccc(C)c(NC(=O)CSc2nnc(-c3sc4ncccc4c3N)n2Cc2ccco2)c1,C64794384_decoy,WEE1,Decoy,0.0,-9.44206,-9.24,-2.86,-8.205367106091522
CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@H](Cc3ccccc3)[NH2+][C@]23C(=O)Nc2ccccc23)cc1,C08972200_decoy,WEE1,Decoy,0.0,-7.28941,-6.41,-1.68,-4.636797317861275
CC(C)c1ccc([C@H]2c3[nH]c4ccccc4c3C[C@H]3C(=O)N(C4CC(C)(C)[NH2+]C(C)(C)C4)CC(=O)N23)cc1,C02092587_decoy,WEE1,Decoy,0.0,-9.58438,-6.15,-3.76,-6.208972172195374
Cc1csc([C@H]2C(=[NH2+])NC(SCC(=O)Nc3ccc(C)c(C)c3)=C(C#N)C23CCCCC3)n1,C03440256_decoy,WEE1,Decoy,0.0,-8.0423,-9.77,-3.15,-7.1990090499292805
COc1ccc(OC)c([C@@H]2[C@@H]3CCCC[C@]3(O)CC[NH+]2CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1,C09328641_decoy,WEE1,Decoy,0.0,-8.74484,-5.22,-2.09,-6.099752588878411
NC(=O)C1CC[NH+](CC(=O)N2N=C3/C(=C/c4cccs4)CCC[C@@H]3[C@H]2c2cccs2)CC1,C09846786_decoy,WEE1,Decoy,0.0,-10.4884,-5.19,-1.87,-7.029788941405129
Cc1ccc(C(=O)Nc2ccc(N3CCC([NH2+]CCc4nc5ccccc5[nH]4)CC3)cc2)c(C)c1,C12167461_decoy,WEE1,Decoy,0.0,-8.87453,-10.1,-2.6,-7.207774733147784
CC1(C)[C@H]2CC=C(CC[NH2+]C3CCN(c4ccc(C(=O)N[C@H]5CCCCNC5=O)cc4)CC3)[C@@H]1C2,C12245072_decoy,WEE1,Decoy,0.0,-11.4817,-8.17,-2.07,-8.52771522621933
O=C(NC1CCCC1)c1ccc(N2CCC([NH2+]Cc3c[nH]nc3-c3ccc(Cl)cc3)CC2)cc1,C12246525_decoy,WEE1,Decoy,0.0,-9.88351,-9.06,-1.85,-8.783060709200909
CCOC(=O)c1ccc(NC(=O)[C@H]2C[C@H](Cc3ccccc3)[NH2+][C@@]23C(=O)Nc2ccccc23)cc1,C16026695_decoy,WEE1,Decoy,0.0,-8.00519,-6.08,-2.17,-5.005654032559124
COC(=O)c1c(NC(=O)c2ccc(C(=O)c3ccccc3)cc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C17242868_decoy,WEE1,Decoy,0.0,-10.4084,-10.75,-0.55,-19.816986596040653
Cc1ccc2nc(-c3ccc(NC(=O)C[NH+]4CCC(C(N)=O)(N5CCCCC5)CC4)cc3)sc2c1,C19877491_decoy,WEE1,Decoy,0.0,-8.96514,-7.48,-2.37,-6.09480145578526
C[C@@H]1CCc2c(sc(NC(=O)C[NH+]3CCN(Cc4cccc5ccccc45)CC3)c2C(N)=O)C1,C20568842_decoy,WEE1,Decoy,0.0,-10.5132,-8.72,-2.38,-9.85899995353424
NC(=O)c1c(NC(=O)C[NH+]2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)sc2c1CCCC2,C22921522_decoy,WEE1,Decoy,0.0,-8.81776,-9.61,-4.36,-8.069505973621276
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC3(CCc4ccccc43)CC1)[C@@H](NC(=O)CC[C@H]1CCC[NH2+]C1)C2,C27318047_decoy,WEE1,Decoy,0.0,-9.8138,-9.46,-2.86,-9.406081599329582
O=C(C[NH+]1CCc2sccc2[C@H]1c1cccs1)Nc1ccc(NC(=O)Nc2ccccc2)cc1,C27477426_decoy,WEE1,Decoy,0.0,-9.68925,-5.83,-2.95,-6.222396772015869
CC1=C[C@@H](CNC(=O)Nc2ccccc2)[C@H](C(C)C)C[C@H]1CC(=O)N1CCN(c2cccc[nH+]2)CC1,C30881648_decoy,WEE1,Decoy,0.0,-8.7109,-6.86,-2.35,-5.902302184512524
CC(C)c1ccc(S(=O)(=O)Nc2ccc(N3CC[NH2+]CC3)c(C(=O)NC3CCCC3)c2)cc1,C33121156_decoy,WEE1,Decoy,0.0,-9.59899,-8.86,-1.41,-7.933302248924824
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(NC(=O)C3CCCC3)cc2)N2CCCSC2=[NH+]1,C35337667_decoy,WEE1,Decoy,0.0,-9.71275,-5.38,-2.84,-6.447475133586731
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccc(NC(=O)CCC3CCCC3)c2)N2CCCSC2=[NH+]1,C35337677_decoy,WEE1,Decoy,0.0,-9.83082,-8.07,-1.29,-7.900235231085714
CC[C@H](C)CNC(=O)[C@@H]1CSC2(CCN(C(=O)Nc3ccccc3Br)CC2)[NH2+]1,C35375125_decoy,WEE1,Decoy,0.0,-8.27677,-5.42,-3.56,-5.618639060055213
Cc1ccc(NC(=O)N2CCC3(CC2)[NH2+][C@H](C(=O)NCCc2ccc(Cl)cc2Cl)CS3)c(C)c1,C35768267_decoy,WEE1,Decoy,0.0,-9.92717,-7.75,-3.38,-8.148446725162346
Cc1ccc(NC(=O)c2c(NC(=O)CN3CC[NH+](C)CC3)sc3c2CC[C@@H](C(C)(C)C)C3)c(C)c1,C01017528_decoy,WEE1,Decoy,0.0,-10.9315,-5.42,-3.08,-6.660464452132369
CCOC(=O)[C@@H]1N[C@@]2(c3ccc(Cl)cc3)N3C=C(C)C=CC3=[NH+][C@]2(c2ccc(Cl)cc2)[C@H]1O,C36351168_decoy,WEE1,Decoy,0.0,-6.45551,-4.72,-2.47,-3.743609411699875
O=C(Nc1ccc(Oc2ccccc2)cc1)C1=CC2=[NH+][C@@H](c3ccco3)C[C@@H](C(F)(F)F)N2N1,C01326480_decoy,WEE1,Decoy,0.0,-7.70572,-9.09,-2.98,-6.978641058394076
C[C@H](S[C@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-],C38799178_decoy,WEE1,Decoy,0.0,-7.75246,-8.67,-3.03,-6.7977265288225
O=C(N/N=C/C1=c2ccccc2=[NH+]C1)[C@@H]1C=C(c2ccc(OCc3ccc(Cl)cc3)cc2)NN1,C39006598_decoy,WEE1,Decoy,0.0,-10.1404,-8.96,-1.82,-10.217835473238566
NC1=[NH+][C@H](c2ccc(Cl)cc2)NC(SCC(=O)N2c3ccccc3CCc3ccccc32)=N1,C39448854_decoy,WEE1,Decoy,0.0,-9.9859,-9.81,-1.78,-8.817483790905067
NC1=[NH+][C@@H](c2cccc(Br)c2)NC(SCC(=O)N2c3ccccc3CCc3ccccc32)=N1,C39448905_decoy,WEE1,Decoy,0.0,-10.2969,-9.78,-2.72,-9.440731119357478
Cc1ccc([C@H](C)NC(=O)[C@H]2CN(C(=O)[C@H](Oc3ccccc3)C(C)C)CC23CC[NH2+]CC3)cc1,C39639422_decoy,WEE1,Decoy,0.0,-9.06844,-8.78,-1.97,-9.644084987426988
Cc1cccc2c(CCNC(=O)[C@@H]3CN(C(=O)c4ccc(-c5ccc(F)cc5)o4)CC34CC[NH2+]CC4)c[nH]c12,C39684223_decoy,WEE1,Decoy,0.0,-8.78098,-6.0,-3.17,-5.410871264792799
COc1ccc([C@@H](Nc2cc(C)cc[nH+]2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)cc1,C38551044_decoy,WEE1,Decoy,0.0,-11.5752,-7.72,-2.28,-9.147128637093909
Cc1nc(-c2cnccn2)sc1[C@@H]1CSC[C@@H](C(=O)N[C@H](C)c2cccc3ccccc23)[NH2+]1,C44166839_decoy,WEE1,Decoy,0.0,-10.0172,-6.7,-3.0,-6.492286927585928
CCOC(=O)c1c(NC(=O)CSc2nc3ccc(C)cc3[nH]2)sc2c1CC(C)(C)[NH2+]C2(C)C,C12519926_decoy,WEE1,Decoy,0.0,-8.66934,-8.17,-2.7,-8.162444316659379
Cc1ccc(S(=O)(=O)N/[NH+]=c2\oc3ccc([N+](=O)[O-])cc3cc2C(=O)Nc2ccccc2C)cc1,C59170464_decoy,WEE1,Decoy,0.0,-9.24668,-10.68,-2.85,-9.809850786079185
NS(=O)(=O)c1ccc(/[NH+]=c2\oc3ccc(Cl)cc3cc2C(=O)Nc2ccc(Cl)cc2)cc1,C59170529_decoy,WEE1,Decoy,0.0,-10.8029,-6.09,-3.85,-6.426078540452946
Cc1ccc2o/c(=[NH+]\c3ccc(S(N)(=O)=O)cc3)c(C(=O)Nc3ccccc3Br)cc2c1,C59170582_decoy,WEE1,Decoy,0.0,-10.0027,-5.79,-2.21,-6.439601611914941
CCOC(=O)c1ccc(NC(=O)N2Cc3[nH]c[nH+]c3C[C@H]2c2nc(-c3ccc(C)cc3)no2)cc1,C12530378_decoy,WEE1,Decoy,0.0,-7.87638,-5.11,-3.3,-4.616273495323591
COc1ccc(NC(=O)N2Cc3[nH]c[nH+]c3C[C@H]2c2nc(-c3ccc(C(F)(F)F)cc3)no2)cc1,C15675778_decoy,WEE1,Decoy,0.0,-8.94881,-6.69,-3.43,-5.016706987706161
O=C(NC1CCCCC1)N1Cc2[nH]c[nH+]c2C[C@H]1c1nc(-c2ccc(OC(F)(F)F)cc2)no1,C15675832_decoy,WEE1,Decoy,0.0,-8.64246,-7.16,-1.63,-6.766915635313676
COc1ccc(NC(=O)N2Cc3[nH]c[nH+]c3C[C@H]2c2nc(-c3ccc(OC(F)(F)F)cc3)no2)cc1,C15675839_decoy,WEE1,Decoy,0.0,-9.58362,-6.31,-2.73,-5.697605226723399
O=C(NCc1ccc(C(F)(F)F)cc1)[C@@H]1Cc2[nH+]c[nH]c2CN1C(=O)Nc1ccc(Cl)cc1,C15676190_decoy,WEE1,Decoy,0.0,-9.071,-8.35,-2.86,-7.847289397225922
CCOC(=O)c1ccc(NC(=O)N2Cc3[nH]c[nH+]c3C[C@H]2c2nc(-c3ccc(Cl)cc3)no2)cc1,C15707188_decoy,WEE1,Decoy,0.0,-10.1762,-9.03,-1.46,-7.5402911800187535
COc1ccc(OC)c([C@H]2[NH2+][C@@H](c3cc(OC)ccc3OC)[C@@H](C)C(O)(c3ccc(F)cc3)[C@@H]2C)c1,C15768956_decoy,WEE1,Decoy,0.0,-7.78661,-6.23,-3.57,-4.771447827828703
[NH2+]=C(N/N=C/c1c(O)ccc2ccccc12)S[C@H]1CC(=O)N(c2ccc(Br)cc2)C1=O,C04100113_decoy,WEE1,Decoy,0.0,-9.54802,-6.32,-4.03,-5.765949417964333
C[C@@H]1[C@H](C)CCC[C@@H]1NC(=O)CS[C@@H]1NN=C(C2=c3ccccc3=[NH+]C2)N1c1ccc(Cl)cc1,C39946180_decoy,WEE1,Decoy,0.0,-9.50511,-8.12,-2.82,-7.809477126214517
O=C(NC[C@@H]1C=c2cc(Cl)ccc2=[NH+]1)[C@H]1C[C@@H]2N[C@H](c3ccc(Cl)cc3)C[C@H](C(F)(F)F)N2N1,C63537910_decoy,WEE1,Decoy,0.0,-8.34905,-6.59,-1.46,-6.259281744489035
Cc1cc(Cl)ccc1N/C(=N\C(=O)c1ccc2c(c1)OCO2)NCCC1=c2ccccc2=[NH+]C1,C63588635_decoy,WEE1,Decoy,0.0,-8.9771,-7.52,-4.79,-7.0645099322480815
O=C(CCC1=c2ccccc2=[NH+]C1)Nc1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1O,C63820519_decoy,WEE1,Decoy,0.0,-9.42875,-10.44,-3.18,-9.526637950743542
COc1ccc(C(=O)N[C@@H]2NC3=C(C(=O)NCCC4=c5ccccc5=[NH+]C4)CCC[C@@H]3S2)cc1,C64375482_decoy,WEE1,Decoy,0.0,-8.8804,-9.23,-1.46,-9.1079119820858
CCCc1ccc(S(=O)(=O)N2CCC3(CC2)NCC[NH+]=C3NCc2cc(F)cc(F)c2)cc1,C65074622_decoy,WEE1,Decoy,0.0,-10.0096,-8.81,-4.18,-9.296062359764182
COc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2cccc(OC)c2OC)N3)cc1,C00869707_decoy,WEE1,Decoy,0.0,-9.04375,-5.99,-3.75,-5.507740514515025
O=C(NCc1ccccc1)/C(=C\c1ccc(Br)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1,C08809384_decoy,WEE1,Decoy,0.0,-6.47935,-5.71,-1.53,-4.583335741830191
O=C(NC(=S)Nc1cc(Cl)c(Cl)cc1Cl)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1,C08833005_decoy,WEE1,Decoy,0.0,-10.1707,-8.91,-1.47,-13.90596613156882
Cc1nc(SCC2=C(C(=O)OC(C)C)[C@H](c3cccs3)C(C#N)=C(N)O2)c(C#N)c(C)c1C,C08965442_decoy,WEE1,Decoy,0.0,-10.2443,-7.69,-1.13,-8.352088761513093
CC(C)(C)c1ccc(S(=O)(=O)c2cnc(SCC(=O)Nc3ccc(F)c(F)c3)[nH]c2=O)cc1,C10272803_decoy,WEE1,Decoy,0.0,-9.74161,-8.53,-3.82,-8.475780549809102
CC1=C(C(=O)Nc2cc(C)on2)[C@H](c2ccc(OC(F)(F)F)cc2)NC(=S)N1c1ccccc1,C10353145_decoy,WEE1,Decoy,0.0,-7.66243,-5.42,-3.7,-5.055172575706215
Cc1ccc(NC(=O)NC(=O)CSc2nc3ccccc3c(=O)n2-c2ccc(F)cc2F)c(C)c1,C10440979_decoy,WEE1,Decoy,0.0,-10.1052,-9.34,-2.1,-8.593100403608762
COc1ccc(Cl)cc1NC(=O)CSc1nnc(NC(=O)C23CC4CC(CC(C4)C2)C3)s1,C12180497_decoy,WEE1,Decoy,0.0,-9.71802,-8.84,-2.44,-8.339880728093899
CC(=O)Nc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(C)cc3)c(-c3ccc(C)cc3)n2)cc1,C03273524_decoy,WEE1,Decoy,0.0,-10.1389,-8.11,-4.75,-9.079279520782809
Cc1cc(C)cc(NC(=O)CNc2cc(S(=O)(=O)N3CCCCC3)ccc2N2CCCCC2)c1,C12549417_decoy,WEE1,Decoy,0.0,-9.2004,-9.52,-2.54,-8.454426647037126
CC(C)c1ccc(OCc2nnc(SCC(=O)N3CC[C@@H](C)Sc4ccccc43)n2N)cc1,C13148798_decoy,WEE1,Decoy,0.0,-8.33014,-9.14,-2.07,-7.327297674762339
Cc1cc(C)cc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc4[nH]c(-c5ccccc5)nc4c3)C2)c1,C09406872_decoy,WEE1,Decoy,0.0,-8.56698,-10.14,-2.61,-7.246548968463935
Cc1cc(F)ccc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)C1,C09406911_decoy,WEE1,Decoy,0.0,-9.80288,-11.2,-3.36,-11.374097415033514
O=C(NC1CCCCC1)c1ccccc1NC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1,C13685014_decoy,WEE1,Decoy,0.0,-8.26739,-9.86,-1.89,-10.98294366040312
C=CCSc1nnc2c(n1)O[C@@H](c1c[nH]nc1-c1ccccc1)Nc1ccc(Br)cc1-2,C15016240_decoy,WEE1,Decoy,0.0,-10.5869,-9.78,-2.06,-9.723798502630624
C=CCNC(=O)c1ccc(N2C(=O)[C@H]3Cc4c([nH]c5ccccc45)[C@@H](c4ccc(C)cc4)N3C2=O)cc1,C15959627_decoy,WEE1,Decoy,0.0,-8.77029,-5.95,-3.63,-5.867225203204839
CC(=O)Nc1ccc(C(=O)N/N=C/c2cc(Br)ccc2OC(=O)c2ccccc2)cc1,C16321175_decoy,WEE1,Decoy,0.0,-8.61702,-8.84,-3.99,-8.533244449992523
Cc1ccc(OCC(=O)Nc2ccccc2C(=O)Nc2ccc3c(c2)OCO3)c(Br)c1,C20008221_decoy,WEE1,Decoy,0.0,-8.78925,-5.7,-2.42,-5.488915119263042
COC(=O)c1c(NC(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2)sc2c1CCCCC2,C20570345_decoy,WEE1,Decoy,0.0,-9.68785,-10.52,-2.31,-9.413609388605762
COC(=O)c1sc2ccccc2c1NC(=O)c1cccc(NS(=O)(=O)c2ccc(C)cc2)c1,C20570674_decoy,WEE1,Decoy,0.0,-9.41493,-6.13,-2.38,-5.663742752255383
Cc1cc(NC(=O)C2CCN(c3ccc(-c4cccs4)nn3)CC2)ccc1NC(=O)c1ccccc1,C20991821_decoy,WEE1,Decoy,0.0,-9.60075,-10.05,-3.0,-8.011502306737038
Cc1ccc(-n2c(Cc3cccc4ccccc34)nnc2SCC(=O)NC(=O)NC2CC2)c(C)c1,C24832981_decoy,WEE1,Decoy,0.0,-8.7961,-10.09,-2.27,-12.01227361006219
O=c1oc2c(c(O)c1[C@H](c1cccc([N-]S(=O)(=O)c3cccc[nH+]3)c1)C1CC1)CCCCCC2,C13761675_decoy,WEE1,Decoy,0.0,-8.0572,-6.27,-4.49,-5.487254707110559
Cc1ccc(-n2c(SCC(=O)N/N=C\c3ccc(O)cc3)nc3sc4c(c3c2=O)CCCC4)cc1,C32577036_decoy,WEE1,Decoy,0.0,-9.21458,-9.51,-1.56,-8.502121921743921
CCN1C(=S)N[C@H](c2cccc(NS(=O)(=O)c3ccc4ccccc4c3)c2)C(C(=O)OC)=C1C,C04146288_decoy,WEE1,Decoy,0.0,-8.76776,-10.23,-2.87,-9.510568889634795
N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc(C(F)(F)F)c2)[C@H]2CN(C(=O)OCc3ccccc3)CC=C12,C34944385_decoy,WEE1,Decoy,0.0,-9.07616,-9.43,-1.28,-9.774459039141982
CCCCN1C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(Cl)cc3)[C@H]3C=C[C@@]2(O3)[C@@H]1C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C,C35229947_decoy,WEE1,Decoy,0.0,-8.66628,-6.23,-4.44,-5.631898979433684
CC(C)c1ccc(NC(=O)[C@H]2[C@H]3C=C[C@]4(O3)[C@H]2C(=O)N(C2CC2)[C@@H]4C(=O)N[C@H]2CCC[C@@H](C)[C@H]2C)cc1,C35242796_decoy,WEE1,Decoy,0.0,-8.07179,-7.2,-3.01,-7.286049944943132
Cc1cccc(CN2C(=O)O[C@H](c3ccc(NC(=O)C(C)C)cc3)[C@H]2C(=O)Nc2cccc(F)c2)c1,C35752367_decoy,WEE1,Decoy,0.0,-9.22256,-6.03,-3.6,-6.879022842516072
COc1ccc(NC(=O)[C@@H]2C[C@@H](c3ccc(F)c(C)c3)CN(C(=O)Nc3ccccc3)C2)cc1OC,C35918834_decoy,WEE1,Decoy,0.0,-8.48465,-7.47,-3.66,-6.614711337145662
Cc1ccc(CN2C(=O)O[C@@H](c3ccc(NC(=O)c4cccc(C)c4)cc3)[C@H]2C(=O)NC(C)C)cc1,C36217079_decoy,WEE1,Decoy,0.0,-8.26614,-8.1,-2.49,-6.692508227932591
Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)c2C(F)(F)F)cc1,C36714435_decoy,WEE1,Decoy,0.0,-9.02124,-10.94,-1.16,-9.930883563470562
CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3oc4ccc(F)cc4c3C)ccc21,C38700652_decoy,WEE1,Decoy,0.0,-9.05454,-6.26,-3.54,-5.630161110961329
O=C(N/N=C/[C@H]1C=NN=C1c1ccc(Cl)c(Cl)c1)[C@H]1C=CN(Cc2ccc(Cl)cc2Cl)N1,C39253057_decoy,WEE1,Decoy,0.0,-10.2611,-9.64,-4.04,-9.028824354128496
O=C(N/N=C/[C@@H]1C=NN=C1c1ccc(Cl)c(Cl)c1)[C@H]1C=CN(Cc2ccc(Cl)cc2Cl)N1,C39253058_decoy,WEE1,Decoy,0.0,-9.45638,-9.03,-2.1,-10.226391040584287
N#CC1=C(N)O[C@H]2N=NC(CSc3nc(-c4ccccc4)ccc3C#N)=C2[C@H]1c1ccc(F)cc1,C39315362_decoy,WEE1,Decoy,0.0,-9.51681,-11.56,-1.18,-10.041016287875928
C[C@H](NC(=O)CN1C(=O)N[C@](C)(c2ccc(OC(F)F)cc2)C1=O)c1ccc(Cl)cc1Cl,C39578198_decoy,WEE1,Decoy,0.0,-6.99003,-9.97,-0.49,-8.862124166931062
COc1cc([C@H]2C(C#N)=C(N)O[C@H]3N=NC(C)=C23)cc(Br)c1OCc1cccc(F)c1,C39962536_decoy,WEE1,Decoy,0.0,-9.31906,-6.07,-2.26,-5.358120586081054
CCCC1=C2[C@H](c3cccc(OC)c3OCc3ccc(Br)cc3)C(C#N)=C(N)O[C@@H]2N=N1,C39964317_decoy,WEE1,Decoy,0.0,-8.17372,-4.39,-2.84,-5.412960744068091
CCCSc1nc2n(n1)[C@H](c1ccc(Br)o1)C(C(=O)Nc1ccc(C)cc1)=C(C)N2,C40982589_decoy,WEE1,Decoy,0.0,-7.47702,-8.48,-4.98,-7.424371591819089
COc1ccc([C@@H]2[NH2+][C@](C(=O)[O-])(c3ccccc3)[C@@H]3C(=O)N(c4ccccc4C)C(=O)[C@H]32)c2ccccc12,C43221526_decoy,WEE1,Decoy,0.0,-6.03307,-5.77,-4.84,-4.814489617478409
CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccncc2)n2nc(SCc3ccccc3F)nc2N1,C09781233_decoy,WEE1,Decoy,0.0,-8.27316,-5.84,-2.94,-5.155510059439764
COc1ccc(C(=O)N/N=C(\C)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@H](c2cccc(OC)c2OC)N3)cc1,C36080571_decoy,WEE1,Decoy,0.0,-8.27634,-9.41,-2.7,-8.14335064759197
O=C(C[C@@H]1C(=O)N(c2ccccc2)C(=S)N1NC(=O)c1ccc(Cl)cc1)Nc1ccc(F)cc1,C35240456_decoy,WEE1,Decoy,0.0,-8.65798,-6.74,-3.86,-6.397968594397458
O=C(CSc1nnc2c(n1)[nH]c1ccccc12)Nc1nc(-c2ccc(Br)cc2)cs1,C59271729_decoy,WEE1,Decoy,0.0,-10.2187,-8.69,-1.17,-9.015240082807246
CC(C)OC(=O)c1c(NC(=O)c2cnn3c2N[C@@H](c2ccccc2)C[C@H]3C(F)F)sc2c1CCCC2,C18209884_decoy,WEE1,Decoy,0.0,-9.07628,-9.77,-3.57,-9.22408756890998
COC(=O)[C@@H]1C2=C(CCCC2)S[C@H]1NC(=O)CSc1nc(-c2ccc(Cl)cc2Cl)n[nH]1,C39945823_decoy,WEE1,Decoy,0.0,-10.2083,-8.18,-1.78,-8.108508365027145
COc1cc([C@@H]2C(C#N)=C(N)OC3=NN=C(c4ccccc4)[C@H]32)ccc1OCc1ccccc1Cl,C08566471_decoy,WEE1,Decoy,0.0,-9.41763,-8.32,-0.69,-8.39571438673142
COc1cc([C@H]2C(C#N)=C(N)OC3=NN=C(c4ccc(C)cc4)[C@@H]32)ccc1OCc1ccccc1F,C20368448_decoy,WEE1,Decoy,0.0,-9.31871,-8.73,-0.71,-10.54433392814044
CCC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3[C@H]2CC(=O)Nc2ccc(Cl)cc2)cc1,C64928186_decoy,WEE1,Decoy,0.0,-9.93644,-8.54,-3.65,-8.458178431615993
COC(=O)c1c(N)sc2c1CCN(c1ccc3c(C(F)(F)F)cc(C(F)(F)F)nc3[nH+]1)C2,C04398130_decoy,WEE1,Decoy,0.0,-9.26944,-7.19,-1.01,-6.650463822677703
Nc1c(Cl)c(Cl)[nH+]c(C(=O)OCC(=O)N(Cc2ccccc2)Cc2ccccc2)c1Cl,C09492092_decoy,WEE1,Decoy,0.0,-8.77528,-6.86,-1.83,-7.399186472178528
O=C(Nc1ccccc1O)C1CC[NH+](CC(=O)N2c3ccccc3OC[C@H]2c2ccccc2)CC1,C09578810_decoy,WEE1,Decoy,0.0,-8.83884,-6.25,-3.35,-6.289208870736273
C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccs1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1,C11044353_decoy,WEE1,Decoy,0.0,-9.88092,-9.09,-5.52,-7.587269659153669
C[C@H]([NH2+][C@H](c1ccccc1)c1cccs1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1,C11044359_decoy,WEE1,Decoy,0.0,-9.85917,-9.24,-0.98,-9.279827189369678
CC(C)(C)C(=O)NC(=S)Nc1ccccc1C(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C12138047_decoy,WEE1,Decoy,0.0,-8.50307,-6.81,-2.23,-8.180520152159854
O=C(CC1CCCC1)Nc1cccc(N2CCC([NH2+]C[C@H]3CCCN(c4ncccn4)C3)CC2)c1,C12206307_decoy,WEE1,Decoy,0.0,-10.572,-7.54,-3.05,-6.77868801264381
C[C@H](Cc1cncs1)[NH2+]C1CCN(c2cccc(NS(=O)(=O)c3ccc(F)cc3)c2)CC1,C12246639_decoy,WEE1,Decoy,0.0,-9.52997,-10.1,-3.68,-8.698939122188463
COc1ccc([C@@H](Nc2cccc[nH+]2)c2c(NC(=O)c3ccccc3)sc(C)c2C)cc1OC,C02546462_decoy,WEE1,Decoy,0.0,-11.0506,-8.81,-3.05,-10.068071531048716
CCOC(=O)c1c(NC(=O)C[NH+]2C3CCC2CC3)sc(C(=O)Nc2ccc(C)cc2C)c1C,C14254139_decoy,WEE1,Decoy,0.0,-9.35745,-9.15,-1.74,-9.120201610091494
COc1ccc(C[NH+]2CCC(O)(c3ccc4oc(C(=O)NC[C@@H]5CCCO5)cc4c3)CC2)c(C)c1C,C14881248_decoy,WEE1,Decoy,0.0,-10.1888,-8.56,-2.42,-7.231690300482167
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C[NH+]3CCCC3)c2C(=O)Nc2cccc([N+](=O)[O-])c2)C1,C15946704_decoy,WEE1,Decoy,0.0,-8.46766,-5.29,-2.62,-5.218418715875361
C[C@H](C(=O)N1CCN(C)CC1)[C@@H]1CC[C@@]2(C)Cc3sc(NCc4ccccc4)[nH+]c3[C@@H](C)[C@@H]2[C@H]1O,C20504497_decoy,WEE1,Decoy,0.0,-10.013,-7.14,-2.86,-7.620103216855666
CCc1ccccc1NC(=O)c1cc2c(CO)cnc(C)c2o/c1=[NH+]\c1cc(OC)cc(OC)c1,C02953173_decoy,WEE1,Decoy,0.0,-10.1151,-8.89,-0.92,-10.102644728865847
COc1cc(C[NH2+]C2CCCCC2)cc(Br)c1OC[C@H](O)c1ccc2c(c1)OCO2,C20876958_decoy,WEE1,Decoy,0.0,-10.0164,-8.59,-1.71,-8.138721634092807
O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1,C23554891_decoy,WEE1,Decoy,0.0,-10.7277,-10.21,-2.01,-14.02937959973164
C[NH+](CC(=O)Nc1cccc(C(=O)NC2CC2)c1)Cc1ccc(-c2ccc(Br)cc2)o1,C25051169_decoy,WEE1,Decoy,0.0,-8.16094,-8.3,-3.97,-8.315875137748586
Cc1cc(N2CCCC2)ccc1NC(=O)C[NH+]1CCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl,C26458636_decoy,WEE1,Decoy,0.0,-8.77765,-8.79,-2.34,-7.367893831954895
CC(C)(C)OC(=O)N[C@H]1CC[NH+](CC(=O)N[C@@H]2CCc3cc(F)ccc3[C@@H]2Cc2cccnc2)C1,C29394708_decoy,WEE1,Decoy,0.0,-8.748,-7.63,-3.03,-7.884403805491595
COc1ccccc1NC(=O)C1CC[NH+](CC(=O)Nc2ccccc2Sc2ccccc2)CC1,C29904093_decoy,WEE1,Decoy,0.0,-8.1811,-7.27,-3.53,-6.700833510673364
C[C@H](NC(=O)c1ccccc1NC(=O)[C@H]1CCC[NH+](Cc2nc(-c3cccs3)no2)C1)c1ccccc1,C31056713_decoy,WEE1,Decoy,0.0,-9.53996,-9.27,-4.1,-10.213926993022405
CCOC(=O)c1c(/[NH+]=c2/oc3ccc(Br)cc3cc2C(N)=O)sc2c1CCCC2,C01507372_decoy,WEE1,Decoy,0.0,-8.8765,-9.38,-4.88,-11.319711943061147
Cc1sc2nc(CSc3ccc(Cl)cc3)nc(NCC[NH2+][C@H]3CCS(=O)(=O)C3)c2c1C,C32809991_decoy,WEE1,Decoy,0.0,-11.0912,-7.77,-2.04,-9.15965717300858
Cc1ccc(NC(=O)Nc2ccc(N3CCCN(C(=O)c4ccc(Cl)cc4Cl)CC3)[nH+]c2)c(C)c1,C34681296_decoy,WEE1,Decoy,0.0,-10.2787,-9.46,-3.55,-7.83405519920265
CCc1c(C)sc2nc(SCC(N)=O)nc(N3CC[NH+](Cc4cc(C)ccc4C)CC3)c12,C34762186_decoy,WEE1,Decoy,0.0,-11.0256,-7.43,-2.02,-9.004682408692792
Nc1c2c(-c3ccccc3F)nc(N3CCC([NH+]4CCCCC4)CC3)nc2nn1-c1cccc(F)c1,C37359407_decoy,WEE1,Decoy,0.0,-7.60354,-5.93,-1.31,-4.419953788390834
COc1ccc([C@@H](c2c(NC(=O)c3ccccc3)sc(C)c2C)[NH+]2CCN(CCO)CC2)cc1,C20193392_decoy,WEE1,Decoy,0.0,-7.96974,-4.31,-2.87,-4.955416176995531
CCc1c(C)sc(NC(=O)C2=CC3=[NH+][C@@H](c4ccc(Cl)cc4)C[C@H](C(F)(F)F)N3N2)c1C#N,C03011520_decoy,WEE1,Decoy,0.0,-8.96841,-9.66,-3.47,-8.05352361444369
COc1cccc([C@@H](Nc2cc(C)cc[nH+]2)c2c(NC(=O)c3ccccc3)sc(C)c2C)c1OC,C38547528_decoy,WEE1,Decoy,0.0,-8.29674,-9.02,-2.34,-9.00103876593422
COc1cccc([C@@H](Nc2cccc(C)[nH+]2)c2c(NC(=O)c3ccccc3)sc(C)c2C)c1OC,C38547532_decoy,WEE1,Decoy,0.0,-9.08141,-9.08,-2.85,-9.102419632307775
COc1ccc(OC)c([C@@H](Nc2cccc[nH+]2)c2c(NC(=O)c3ccccc3)sc(C)c2C)c1,C38547534_decoy,WEE1,Decoy,0.0,-10.1209,-6.13,-3.08,-5.997942366366233
Cc1cccc(N[C@H](c2ccc(OC(F)F)cc2)c2c(NC(=O)c3ccco3)sc(C)c2C)[nH+]1,C38547662_decoy,WEE1,Decoy,0.0,-9.92303,-7.45,-2.47,-8.652143813563837
COc1cccc([C@H](Nc2cccc(C)[nH+]2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1OC,C38547701_decoy,WEE1,Decoy,0.0,-7.35437,-4.57,-2.73,-4.15269280791377
COc1ccc(OC)c([C@H](Nc2cc(C)cc[nH+]2)c2c(NC(=O)c3ccco3)sc(C)c2C)c1,C38547709_decoy,WEE1,Decoy,0.0,-10.2194,-6.21,-2.78,-6.9333882306520405
Cc1cccc(C)c1NC(=O)C[NH+]1CCN(CC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)CC1,C23302782_decoy,WEE1,Decoy,0.0,-9.38187,-7.04,-1.9,-5.540904396382359
O=S(=O)(Oc1ccccc1)[C@@H]1CN([C@H](CNCl)c2ccc(-c3ccccc3)cc2)CC[NH2+]1,C39533903_decoy,WEE1,Decoy,0.0,-9.83143,-9.86,-1.8,-9.723438290237423
C[C@@H]1[C@H](C)CCC[C@@H]1NC(=O)[C@@H]1CN(C(=O)c2cccnc2Oc2ccc(Cl)cc2)CC12CC[NH2+]CC2,C39637409_decoy,WEE1,Decoy,0.0,-8.843,-6.34,-4.58,-5.03688710712151
CC(=O)/[NH+]=c1/ccc2c(COC(=O)[C@H](NC(=O)c3ccc(C(C)(C)C)cc3)C(C)C)cc(O)oc-2c1,C39642036_decoy,WEE1,Decoy,0.0,-10.9676,-7.92,-2.78,-8.498563186038076
COc1ccc(CC[C@H](C)NC(=O)[C@H]2CN(C(=O)C3(C)CCCCC3)CC23CC[NH2+]CC3)cc1,C39675308_decoy,WEE1,Decoy,0.0,-8.27969,-6.17,-2.12,-6.097984651071122
COc1ccc([C@H](Nc2cccc[nH+]2)c2c(NC(=O)c3ccco3)sc3c2CCCC3)c(OC)c1,C38550662_decoy,WEE1,Decoy,0.0,-11.917,-5.51,-1.86,-7.7080383283716145
CCC[NH+](CCN1CCN(c2ccc(-c3ccncc3)cc2)CC1)[C@H]1CCc2nc(N)sc2C1,C45254546_decoy,WEE1,Decoy,0.0,-10.9525,-8.63,-1.32,-7.690571551285856
COc1ccc(N2C(=O)C[C@H](SC(=[NH2+])N/N=C(\C)c3ccc(-c4ccccc4)cc3)C2=O)cc1,C59489320_decoy,WEE1,Decoy,0.0,-8.78699,-9.41,-1.61,-8.050803593700747
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NC[C@@]3([NH+](C)C)CCC[C@@H](C)C3)c2)cc1,C59890765_decoy,WEE1,Decoy,0.0,-8.87852,-9.17,-3.04,-9.282152646293406
O=C(CS[C@H]1NN=C(SCc2ccccc2Cl)S1)N/N=C/C1=c2ccccc2=[NH+]C1,C38915385_decoy,WEE1,Decoy,0.0,-10.9972,-7.48,-2.83,-8.331299675154598
COc1ccc(/C=N/NC(=O)CC2=c3ccccc3=[NH+]C2)cc1CS[C@H]1Nc2ccccc2O1,C63406128_decoy,WEE1,Decoy,0.0,-8.81196,-9.98,-2.36,-8.134763965727632
CCN1C[C@@H](/C=C(\NC(=O)c2ccc(C)cc2)C(=O)NCCC2=c3ccccc3=[NH+]C2)c2ccccc21,C63514451_decoy,WEE1,Decoy,0.0,-7.61199,-8.49,-2.3,-9.08481736998813
O=C(NCCC1=c2ccccc2=[NH+]C1)[C@@H]1NN2C(C(F)(F)F)=CC(c3cccs3)=N[C@H]2[C@H]1Cl,C63541084_decoy,WEE1,Decoy,0.0,-8.68345,-7.27,-2.12,-6.0316018905625945
O=C(NCc1ccccc1F)[C@@H](CC1=c2ccccc2=[NH+]C1)NS(=O)(=O)c1ccc(Cl)cc1,C63778231_decoy,WEE1,Decoy,0.0,-9.60509,-9.51,-3.64,-10.613060527437437
O=C(N[C@H](CC1=c2ccccc2=[NH+]C1)C(=O)Nc1ccc(OC(F)(F)F)cc1)c1cccs1,C64220377_decoy,WEE1,Decoy,0.0,-8.99306,-9.03,-2.64,-8.204731847603865
O=C(CCC1=c2ccccc2=[NH+]C1)Nc1cccc(OCC2=NN[C@H](c3ccc(Cl)cc3)O2)c1,C64610978_decoy,WEE1,Decoy,0.0,-9.12149,-10.63,-1.44,-9.024627921478071
C[C@H](C(=O)N(C)CCC#N)[C@H]1CC[C@]2(C)Cc3sc(NC(=O)CC(C)(C)C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840753_decoy,WEE1,Decoy,0.0,-9.56104,-5.2,-3.38,-5.5689781497539865
COc1cccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)C[C@@H](c2ccco2)C3)c1OCc1ccc(F)cc1,C00718366_decoy,WEE1,Decoy,0.0,-8.37438,-5.16,-2.77,-4.616849420213587
COc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1NS(=O)(=O)c1cccs1,C06292397_decoy,WEE1,Decoy,0.0,-10.2763,-9.16,-3.15,-9.022539156989364
CCOC(=O)c1c(NC(=S)NC(=O)c2nn(C)cc2Br)sc2c1CC[C@H](C)C2,C00694733_decoy,WEE1,Decoy,0.0,-9.12473,-8.05,-1.03,-9.651259169002191
O=C(NC(=S)Nc1ccc(Cl)cc1C(F)(F)F)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1,C08833006_decoy,WEE1,Decoy,0.0,-8.31193,-9.1,-3.91,-7.2197422152990365
CC[C@@H](N1C(=O)N[C@](NC(=O)c2ccc(OC)cc2)(C(F)(F)F)C1=O)C12CC3CC(CC(C3)C1)C2,C08868517_decoy,WEE1,Decoy,0.0,-8.66487,-5.43,-1.7,-5.892265527168213
C[C@@H]1CCc2c(sc(NC(=O)[C@@H](C)Oc3ccc(F)cc3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C09209511_decoy,WEE1,Decoy,0.0,-9.91561,-9.56,-4.36,-10.0871147566646
CCOC(=O)C1=C(N)OC2=C(C(=O)CCC2)[C@]12C(=O)N1c3c2cccc3[C@@](C)(c2ccccc2)CC1(C)C,C02441272_decoy,WEE1,Decoy,0.0,-7.33006,-4.68,-2.63,-4.86748110275982
CN(C)S(=O)(=O)c1ccc(C(=O)NC(=S)Nc2cccc(-c3nc4ccccc4s3)c2)cc1,C09404719_decoy,WEE1,Decoy,0.0,-10.0128,-8.3,-1.99,-7.679295380642715
O=C(CSc1nncn1C1CC1)Nc1sc2c(c1C(=O)Nc1ccc(Cl)cc1)CCCC2,C09910194_decoy,WEE1,Decoy,0.0,-11.8505,-8.03,-1.24,-9.762418860404344
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(NC(=O)/C=C/c3ccc(Cl)cc3Cl)CC2)cc1,C10029383_decoy,WEE1,Decoy,0.0,-8.89428,-9.19,-4.56,-9.11857805928272
CCOC(=O)C1=C(Cn2cc(C(F)(F)F)cc(Cl)c2=O)NC(=O)N[C@@H]1c1ccc(Cl)cc1,C10538538_decoy,WEE1,Decoy,0.0,-8.58921,-9.62,-2.61,-10.576696819990037
CC[C@H](N1C(=O)N[C@@](NC(=O)c2ccc(OC)cc2)(C(F)(F)F)C1=O)C12CC3CC(CC(C3)C1)C2,C12418723_decoy,WEE1,Decoy,0.0,-8.63201,-5.96,-2.87,-5.664923174410001
COc1ccc(-c2cnnn2-c2ccc(NC(=S)NC(=O)C34CC5CC(CC(C5)C3)C4)cc2)cc1,C12659586_decoy,WEE1,Decoy,0.0,-10.3101,-8.27,-4.95,-10.159824098606151
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CSc2nc(C)c(C)c(C)c2C(N)=O)cc1,C12972681_decoy,WEE1,Decoy,0.0,-8.91712,-8.77,-2.41,-8.32075190665139
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N[C@H](C(=O)Nc3ccc(F)cc3F)C(C)C)CC2)cc1,C13511775_decoy,WEE1,Decoy,0.0,-8.94155,-9.32,-3.49,-5.5247302619113965
Cc1c(C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CC[C@H](C)C3)oc2ccccc12,C13776212_decoy,WEE1,Decoy,0.0,-8.9274,-10.8,-1.87,-10.145890239782393
C[C@H](NC(=O)CN1C(=O)N[C@](C)(c2ccc(OC(F)F)cc2)C1=O)c1ccc(Br)cc1,C14268117_decoy,WEE1,Decoy,0.0,-8.44282,-9.69,-1.19,-8.86868677460089
COc1cc([C@H]2Nc3ccc(S(=O)(=O)NC4CCCCC4)cc3[C@H]3C=CC[C@@H]32)ccc1OC(C)=O,C14468144_decoy,WEE1,Decoy,0.0,-10.5704,-8.8,-2.42,-8.550559657199754
COc1ccc(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1S(=O)(=O)NC1CCCC1,C14585737_decoy,WEE1,Decoy,0.0,-9.72797,-8.71,-1.19,-8.439111045202015
Cc1cc(NC(=O)[C@@H](C)SCC(=O)Nc2nc(-c3ccc(Br)cc3)c(C)s2)no1,C14911495_decoy,WEE1,Decoy,0.0,-9.19227,-8.13,-4.67,-8.531481973957696
CC(C)C(=O)Nc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Br)cc1,C16017153_decoy,WEE1,Decoy,0.0,-9.49023,-9.44,-0.86,-12.089410162914543
O=S(=O)(/N=C1\CCCCCN1)c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1,C16154816_decoy,WEE1,Decoy,0.0,-9.13386,-9.07,-2.19,-8.360625355299105
CN(c1ccccc1C(=O)Nc1ccccc1C(=O)NC1CCCCC1)S(=O)(=O)c1ccccc1,C16188843_decoy,WEE1,Decoy,0.0,-8.04789,-7.05,-1.9,-8.235517703708743
CNC(=O)c1cccc(NC(=O)CSc2nnc(-c3cc4c(s3)CC[C@H](C(C)(C)C)C4)n2C)c1,C19317396_decoy,WEE1,Decoy,0.0,-11.3969,-8.06,-2.75,-8.149238233005118
C[C@@H]1C[C@H](C(F)(F)F)n2nc(C(=O)OCC(=O)Nc3ccc(I)cc3)cc2N1,C20569457_decoy,WEE1,Decoy,0.0,-8.18085,-9.02,-0.82,-8.118144478957548
COc1cc([C@@H]2Nc3ccc(S(=O)(=O)NC4CCCCC4)cc3[C@@H]3C=CC[C@H]32)ccc1OC(C)=O,C20702089_decoy,WEE1,Decoy,0.0,-8.92621,-9.37,-2.94,-7.004853303147265
CC(C)Cn1c(SCC(=O)NNC(=O)c2cccs2)nc2sc3c(c2c1=O)CC[C@H](C)C3,C21180808_decoy,WEE1,Decoy,0.0,-10.1827,-8.62,-3.9,-12.09493433923932
CC(=O)Nc1c2n(c3sc(C)c(C)c13)C[C@@](C)(C(=O)NC1CCCCCC1)N(CCC(C)C)C2=O,C21522696_decoy,WEE1,Decoy,0.0,-8.84531,-7.47,-2.81,-7.353885802552471
O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1C[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1,C24095366_decoy,WEE1,Decoy,0.0,-8.37958,-9.5,-2.14,-9.238373995692632
Cc1ccc(NC(=O)c2cccnc2SCC(=O)Nc2ccc3c(c2)OCO3)cc1C(F)(F)F,C24827087_decoy,WEE1,Decoy,0.0,-9.25133,-10.41,-2.98,-10.709546468637043
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)[C@@H](NC(=O)c3cccs3)c3ccccc3)CC2)cc1,C25582124_decoy,WEE1,Decoy,0.0,-10.8139,-8.73,-3.87,-10.266893620998006
Cc1ccc(S(=O)(=O)N2CCC(NC(=O)[C@H](NC(=O)c3cccs3)c3ccccc3)CC2)cc1,C25582130_decoy,WEE1,Decoy,0.0,-10.7169,-9.13,-3.43,-8.403779347703866
O=C1CN(c2ccc(NC(=O)c3c4c(nc5ccccc35)/C(=C/c3cccs3)CCC4)cn2)CCN1,C27265196_decoy,WEE1,Decoy,0.0,-10.804,-9.94,-5.06,-8.101912094841197
CC(C)CC(=O)Nc1ccc(NC(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)cc1,C27268788_decoy,WEE1,Decoy,0.0,-8.81134,-8.11,-1.4,-7.374613691725141
COc1ccc(-c2[n-]n(-c3ccccc3)c3[nH+]c(=O)c(CNc4ccc5c(c4)CCC5)cc2-3)cc1OC,C13564737_decoy,WEE1,Decoy,0.0,-10.0129,-10.37,-0.59,-10.561676678929524
CC[C@@H](C)[C@@H](NC(=O)C1CCCC1)C(=O)N1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)[C@H](C)C1,C35100391_decoy,WEE1,Decoy,0.0,-8.24428,-6.38,-3.58,-4.965340995084291
O=C(Nc1ccc([C@H]2OC(=O)N(Cc3ccccc3)[C@@H]2C(=O)Nc2ccccc2)cc1)c1ccccc1,C35751029_decoy,WEE1,Decoy,0.0,-8.66953,-9.28,-4.0,-6.94329379505833
O=C(CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O)Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1,C24831406_decoy,WEE1,Decoy,0.0,-10.7371,-6.22,-1.3,-5.475781581523425
O=C(CSc1nc2sc3c(c2c(=O)n1-c1ccc(Cl)cc1)CCCC3)NC(=O)NC1CC1,C36240498_decoy,WEE1,Decoy,0.0,-9.8792,-8.43,-3.87,-9.152521827151109
C=CCOc1ccc(C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CC[C@@H](C)C3)cc1,C39836285_decoy,WEE1,Decoy,0.0,-10.7701,-9.6,-0.89,-10.633170255582524
COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3cc4cc(F)ccc4s3)cc2)cc1OC,C40157753_decoy,WEE1,Decoy,0.0,-9.2321,-6.87,-3.03,-5.11014530408023
C[C@H]1CCc2c(sc(NC(=O)c3cc4cccc(F)c4o3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C41332142_decoy,WEE1,Decoy,0.0,-10.6847,-10.11,-0.82,-10.23030756943698
O=C(Nc1cccc(NC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c1)C1CC1,C46570056_decoy,WEE1,Decoy,0.0,-8.23255,-9.33,-2.07,-8.379280277053795
COc1ccc(NC(=O)c2nn3c(c2Br)N[C@H](c2cccs2)C[C@H]3C(F)(F)F)c(OC)c1,C00865796_decoy,WEE1,Decoy,0.0,-8.45583,-5.45,-1.53,-5.443060378483416
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)Nc4ccccc4SC)c3N2)cc1OC,C00866080_decoy,WEE1,Decoy,0.0,-9.20196,-7.64,-2.1,-7.401987829927238
Cc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)C2c4ccccc4C3(/C=N/NC(=O)CCCO)c3ccccc32)cc1,C59382349_decoy,WEE1,Decoy,0.0,-7.22234,-5.93,-4.04,-4.34982550741168
O=C(CSc1nnc(-c2ccc(Br)cc2)n1-c1ccccc1)NNC(=O)C1CCC1,C59882607_decoy,WEE1,Decoy,0.0,-8.03178,-8.61,-1.02,-7.248030275896848
CCOC(=O)c1c(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@H](c2cccs2)N3)sc(C)c1C,C13121889_decoy,WEE1,Decoy,0.0,-6.82456,-7.57,-1.52,-8.72162005839387
O=C(Nc1cccc(C(F)(F)F)c1)C1CCN(S(=O)(=O)c2ccc3[nH]c(=O)sc3c2)CC1,C65021967_decoy,WEE1,Decoy,0.0,-8.56317,-6.7,-3.1,-5.2848060309332245
O=C(Nc1ccc(Cl)cc1)c1cccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1,C03266985_decoy,WEE1,Decoy,0.0,-9.52325,-10.58,-2.39,-13.075638210534573
C[C@@H]1[C@@H](C)CCC[C@H]1NS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccccc2Br)c1,C03023312_decoy,WEE1,Decoy,0.0,-8.74274,-9.79,-3.9,-10.960215026798055
Cc1ccc(NS(=O)(=O)c2cc(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)ccc2C)c(C)c1,C02875588_decoy,WEE1,Decoy,0.0,-8.66166,-11.1,-3.86,-8.545090147008942
CCOC(=O)c1c(N[C@@H](NC(=O)c2ccc(C)cc2)C(Cl)(Cl)Cl)sc2c1CCCC2,C03066913_decoy,WEE1,Decoy,0.0,-9.65926,-8.22,-3.12,-9.739204905286227
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3ccco3)c2C(=O)Nc2ccccc2C(F)(F)F)C1,C02984944_decoy,WEE1,Decoy,0.0,-9.14541,-5.72,-1.86,-5.498532623554941
O=C(N/C(=C\c1ccccc1)C(=O)N1CCC(O)(c2ccc(Br)cc2)CC1)c1ccccc1,C08414412_decoy,WEE1,Decoy,0.0,-8.10694,-6.32,-4.33,-5.072892489216518
COCc1cc(C)nc2c1C1=NC(c3ccccc3)(c3ccccc3)c3ccccc3N1C(N)=CS2,C08856105_decoy,WEE1,Decoy,0.0,-6.18145,-5.51,-3.0,-4.066896956881233
COc1c(C(=O)NC(=S)Nc2ccccc2N2CCCC2)cc2ccccc2c1Br,C08835792_decoy,WEE1,Decoy,0.0,-8.63683,-3.57,-2.07,-4.784499329978457
O=C(Nc1ccccc1C(F)(F)F)[C@H]1Sc2nnc(-c3ccccc3)n2N[C@@H]1c1ccccc1,C09238284_decoy,WEE1,Decoy,0.0,-8.19237,-9.77,-0.81,-8.274974409605855
O=C(N[C@H](c1ccc(F)cc1)c1cccs1)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1,C09898734_decoy,WEE1,Decoy,0.0,-8.45343,-7.07,-2.7,-6.986911774221483
COCc1cc(C)nc2sc([C@@H](O)c3ccc(Br)cc3)c(NC(=O)c3ccccc3)c12,C12445358_decoy,WEE1,Decoy,0.0,-9.42686,-6.41,-3.52,-7.763602024564847
Cc1cc(Br)ccc1NC(=O)CNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccccc2s1,C12767399_decoy,WEE1,Decoy,0.0,-7.90722,-9.6,-3.72,-7.801455732050477
COc1c(C)cc(Br)cc1C(=O)NC(=S)Nc1nc2cc(Cl)c(C)cc2s1,C14275623_decoy,WEE1,Decoy,0.0,-10.6,-8.64,-2.84,-8.218892059480432
COc1ccc2ccccc2c1[C@H]1Nc2ccc(S(=O)(=O)NC3CCCCC3)cc2[C@H]2C=CC[C@H]21,C14543915_decoy,WEE1,Decoy,0.0,-8.2651,-8.93,-2.37,-7.364971969214033
Cc1cc(Br)cc(C)c1O[C@@H](C)C(=O)Nc1cccc(C(=O)Nc2ccc(F)cc2)c1,C14555218_decoy,WEE1,Decoy,0.0,-9.02971,-9.5,-2.86,-8.235620719044068
Cc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(OC(C)C)c(Br)c2)cc1C,C14658358_decoy,WEE1,Decoy,0.0,-9.47434,-9.41,-2.33,-8.808547016795076
CC(C)COc1ccc(Br)cc1C(=O)NC(=S)Nc1sc2c(c1C#N)CCCC2,C14667142_decoy,WEE1,Decoy,0.0,-9.5033,-7.95,-4.66,-8.552656734603683
Cc1ccc(C(=O)Nc2ccc(Sc3ccc(Br)cc3)cc2)cc1NC(=O)c1ccco1,C03333466_decoy,WEE1,Decoy,0.0,-8.64893,-9.99,-3.25,-10.740402663176845
CC1CCN(c2ccc(NC(=S)NC(=O)c3ccc(-c4cc(Cl)cc(Cl)c4)o3)cc2)CC1,C16609324_decoy,WEE1,Decoy,0.0,-9.97073,-6.81,0.05,-6.191746104022169
O=C(Nc1sc(N/N=C/c2ccccc2)nc1-c1ccc(Cl)cc1)c1ccc(Br)cc1,C16751460_decoy,WEE1,Decoy,0.0,-10.4637,-9.38,-3.54,-10.010359606396449
CCCOc1ccc(Br)cc1C(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1,C20118175_decoy,WEE1,Decoy,0.0,-8.35388,-8.2,-2.65,-7.764005184016394
NS(=O)(=O)c1ccc(N2N=C(c3ccc(I)cc3)C[C@@H]2c2ccccc2)cc1,C20414216_decoy,WEE1,Decoy,0.0,-9.82645,-5.21,-4.14,-5.446149309794578
CC(C)COc1ccc([C@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@@H]3c2ccc(N(C)C)cc2)cc1,C21239910_decoy,WEE1,Decoy,0.0,-8.91605,-5.93,-2.51,-5.579633126011674
Cc1cc(C)c(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H](C)c2cc(C)c(C)cc2C)c(C)c1,C22539596_decoy,WEE1,Decoy,0.0,-7.13235,-10.44,-3.33,-8.351941129818805
Cc1cccc([C@@H]2CC(=O)C3=C(C2)NC(Nc2nc4ccccc4s2)=N[C@@H]3c2cc(F)cc(F)c2)c1,C22822589_decoy,WEE1,Decoy,0.0,-7.96435,-6.23,-1.86,-4.561119791882808
O=C(CNC(=O)c1cccs1)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1,C22879829_decoy,WEE1,Decoy,0.0,-8.86476,-10.22,-1.06,-8.474179230889957
CC1=C(C(=O)Nc2ccccc2F)[C@@H](c2ccc(N(C)C)cc2)C2=C(C[C@H](c3ccccc3)CC2=O)N1,C10013734_decoy,WEE1,Decoy,0.0,-8.64077,-5.7,-3.1,-6.20846214118883
CCN(CC)c1ccc(/C=C(/NC(=O)c2ccc(Br)cc2)C(=O)Nc2ccccc2)cc1,C28308631_decoy,WEE1,Decoy,0.0,-8.13473,-9.04,-3.27,-7.881430403729592
CN(C)c1ccc(/C=C(/NC(=O)c2ccc(Br)cc2)C(=O)Nc2cccc3ccccc23)cc1,C28308860_decoy,WEE1,Decoy,0.0,-8.52147,-9.82,-1.5,-8.427148054952365
Cc1ccc(C(=O)NC(=S)Nc2ccc3oc(-c4c(F)c(F)c(F)c(F)c4F)nc3c2)c(C)c1,C01849196_decoy,WEE1,Decoy,0.0,-8.09095,-10.39,-1.73,-7.457470618842322
COc1ccc2c(c1)[C@H]1NC(=S)N(c3ccc(C)cc3)[C@@](C)(O2)[C@@H]1C(=O)Nc1ccc(C)cc1C,C02962919_decoy,WEE1,Decoy,0.0,-8.52344,-5.29,-2.37,-5.110118981957436
C[C@H](c1ccccc1)[C@H](C(=O)NC1CCCCC1)N(C)C(=O)C(O)(c1ccccc1)c1ccccc1,C36534616_decoy,WEE1,Decoy,0.0,-8.99945,-4.72,-3.6,-4.35107805701842
COc1ccc2ccccc2c1[C@H]1Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2[C@H]2C=CC[C@H]21,C14543946_decoy,WEE1,Decoy,0.0,-8.06871,-9.63,-4.27,-7.206535068338171
COc1ccc2ccccc2c1[C@@H]1Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2[C@H]2C=CC[C@H]21,C14543948_decoy,WEE1,Decoy,0.0,-8.1241,-7.88,-1.98,-7.439138428778147
Cc1ccc(NC(=O)c2c(F)cccc2F)cc1S(=O)(=O)Nc1ccc(SC(F)F)cc1,C36772532_decoy,WEE1,Decoy,0.0,-9.60399,-5.8,-3.67,-6.098208977141471
C[C@H](NC(=O)c1ccccc1N1CCC(NC(=O)c2ccc(Br)cc2)CC1)c1ccccc1,C37276542_decoy,WEE1,Decoy,0.0,-9.20182,-6.52,-3.06,-6.073109875776479
COc1ccc(NC(=O)c2c(NC(=O)c3ccc(Br)cc3)sc3c2CCCC3)cc1,C08445652_decoy,WEE1,Decoy,0.0,-9.39318,-5.92,-2.04,-6.01914178255112
O=C(NC[C@H](c1cccs1)S(=O)(=O)c1ccc(F)cc1)NC(c1ccccc1)c1ccccc1,C38565700_decoy,WEE1,Decoy,0.0,-9.38335,-9.1,-3.75,-9.588212607142198
Cc1ccc(/C=C/C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(Br)c2)cc1,C38651475_decoy,WEE1,Decoy,0.0,-8.76557,-10.01,-0.3,-7.940036831894318
N#CC1=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc2[C@@H]1c1cccc(Br)c1,C38651538_decoy,WEE1,Decoy,0.0,-8.97144,-10.78,-0.93,-8.636815693706065
CC1CCN(c2ccc(NC(=O)c3c(NC(=O)c4ccccc4)sc4c3CC[C@@H](C)C4)cc2)CC1,C01933709_decoy,WEE1,Decoy,0.0,-10.6442,-9.82,-1.85,-9.767372376883278
Cc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)Nc2ccc(Br)cc2)c(C(=O)c2ccccc2)c1,C39894592_decoy,WEE1,Decoy,0.0,-10.0655,-9.68,-1.85,-11.183600075316214
O=C(Nc1cccc(Cl)c1)c1nn2c(c1Br)N[C@@H](c1cccs1)C[C@@H]2C(F)(F)F,C00673855_decoy,WEE1,Decoy,0.0,-8.0461,-9.14,-1.25,-7.889785843181991
O=C(Nc1cccc(Cl)c1)c1nn2c(c1Br)N[C@H](c1cccs1)C[C@H]2C(F)(F)F,C00673858_decoy,WEE1,Decoy,0.0,-10.1982,-8.57,-2.54,-8.845106801956433
CC1=C(C(=O)OC(C)C)[C@H](c2cc(Br)cc(Br)c2O)C2=C(CC(C)(C)CC2=O)N1,C00825848_decoy,WEE1,Decoy,0.0,-7.04281,-4.92,-2.11,-4.243987334042881
O=C(Nc1ccc(Cl)cc1)c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc(Br)cc1)N2,C00648179_decoy,WEE1,Decoy,0.0,-8.49686,-6.48,-1.99,-5.503796382094315
COc1cc(Br)c(NC(=O)CSc2nc3ccc(C)cc3[nH]2)cc1Br,C59434887_decoy,WEE1,Decoy,0.0,-9.71274,-8.64,-2.3,-8.960523891338847
COc1ccc(C(=O)NC(=S)Nc2cccc(-c3nc4ccccc4s3)c2C)cc1Br,C59438420_decoy,WEE1,Decoy,0.0,-10.1484,-9.57,-2.36,-8.398833405220861
CCN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([NH+](CC)CC)cc1)N2,C59660416_decoy,WEE1,Decoy,0.0,-8.59051,-6.12,-2.53,-6.154567899562467
Cc1ccc([C@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)Nc4ccc(Cl)cc4C(F)(F)F)cc3N2)cc1,C03011834_decoy,WEE1,Decoy,0.0,-7.40839,-9.14,-0.93,-5.89404407146166
FC(F)(F)c1c[nH+]c(N2CCCN(C(=S)Nc3ccc(Cl)c(Cl)c3)CC2)c(Cl)c1,C04480585_decoy,WEE1,Decoy,0.0,-8.21735,-5.2,-1.98,-4.79228231587581
CC(=O)N[C@@H]1CCN(c2cc(-c3ccc(Sc4ccccc4C(C)C)c(C(F)(F)F)c3)cc[nH+]2)C1,C03965943_decoy,WEE1,Decoy,0.0,-8.19984,-10.04,-2.5,-7.697257512934533
CCOC(=O)c1c(/N=C/c2cc(I)ccc2O)sc2c1CC[NH+](C)C2,C08951253_decoy,WEE1,Decoy,0.0,-10.2227,-8.41,-1.22,-11.26302471992116
Cc1ccc(S(=O)(=O)N[C@H](C)[C@H](c2cccs2)[NH+]2CCN(c3ccc(F)cc3)CC2)cc1,C09382658_decoy,WEE1,Decoy,0.0,-9.31953,-7.3,-2.97,-6.771842967215825
C[C@@H](NS(=O)(=O)c1ccc(Br)cc1)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1,C09382626_decoy,WEE1,Decoy,0.0,-8.95925,-6.31,-1.58,-5.851401872662115
CO[C@H]1[C@H](NC(=O)Cc2cccs2)c2ccccc2C12CC[NH+](Cc1cc(F)ccc1F)CC2,C11782799_decoy,WEE1,Decoy,0.0,-9.63632,-5.89,-3.09,-6.6354976131249135
Cc1sc(NC(=O)c2ccco2)c([C@H](c2ccc(F)cc2)[NH+]2CCC(Cc3ccccc3)CC2)c1C,C02667945_decoy,WEE1,Decoy,0.0,-8.25451,-5.33,-3.46,-5.725082518071682
C/C(=N\NC(=O)C[NH+]1CCn2c3c(c4cc(C5CCCCC5)ccc42)CCC[C@H]31)c1ccc(F)cc1,C09434016_decoy,WEE1,Decoy,0.0,-8.58263,-5.93,-1.76,-5.890921107059296
CN(C(=O)c1cccs1)[C@H](Cc1ccccc1F)C1CC[NH+](Cc2cc3ccccc3[nH]2)CC1,C15067906_decoy,WEE1,Decoy,0.0,-9.72764,-5.7,-2.39,-5.718028596471254
O=C(c1ccco1)[C@@H]1[C@@H](C(=O)c2ccc(Cl)cc2)[C@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C16007121_decoy,WEE1,Decoy,0.0,-8.07627,-5.86,-2.84,-5.14979384304053
O=C(c1ccccc1)[C@H]1[C@H](C(=O)c2ccc(F)cc2)[C@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C02258763_decoy,WEE1,Decoy,0.0,-7.84605,-7.34,-1.79,-4.650494232444917
O=C(c1ccc(C#CC2(O)CCCCC2)cc1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C02820168_decoy,WEE1,Decoy,0.0,-9.75329,-9.14,-4.66,-7.355271560512436
COc1cc(CN[C@@H]2C[NH+]3CCC2CC3)cc(Br)c1OCc1ccc(Cl)c(Cl)c1,C20477457_decoy,WEE1,Decoy,0.0,-10.4734,-8.33,-0.2,-14.328758084292677
COc1cc(C[NH2+]Cc2ccco2)cc(Br)c1OCc1ccc(Cl)c(Cl)c1,C20876398_decoy,WEE1,Decoy,0.0,-10.2894,-7.68,-1.01,-7.8150465946746355
CN1CC[NH+](C2=C(NC3CCCCC3)N(c3cccc(C(F)(F)F)c3)C(=S)C23CCCCC3)CC1,C21337465_decoy,WEE1,Decoy,0.0,-9.7259,-5.31,-3.88,-5.672181761497093
COc1cc(C[NH2+]Cc2ccco2)cc(Br)c1OCc1ccc(Cl)cc1Cl,C22076331_decoy,WEE1,Decoy,0.0,-9.9055,-7.78,-2.16,-10.661505050235
COc1cc(C[NH2+][C@H](C)C23CC4CC(CC(C4)C2)C3)cc(Br)c1OCc1cccnc1,C22076908_decoy,WEE1,Decoy,0.0,-9.69069,-8.27,-2.46,-8.169542806440052
O[C@H](COc1ccc(Br)cc1)CN1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C22916689_decoy,WEE1,Decoy,0.0,-9.65829,-5.1,-2.61,-5.688014778781339
Cc1cc(NC(=O)C2CC[NH+](Cc3nc(-c4ccc(F)cc4)no3)CC2)ccc1Br,C30982455_decoy,WEE1,Decoy,0.0,-9.01998,-6.07,-2.77,-5.656690818063426
C[C@H](NC(=O)[C@H](C)[NH+]1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccc(Cl)cc1Cl,C31310163_decoy,WEE1,Decoy,0.0,-8.07549,-8.15,-1.95,-6.79785355260909
CCSc1nc(N2CC[NH+](CC(=O)NC3CCCCC3)CC2)c2c3c(sc2n1)CCCC3,C34755944_decoy,WEE1,Decoy,0.0,-10.9193,-7.75,-0.94,-11.795707958717378
O=C(NCc1ccc(F)cc1)[C@H]1Cc2cc(C(F)(F)F)ccc2N2CCN(c3cccc[nH+]3)C[C@@H]12,C35555853_decoy,WEE1,Decoy,0.0,-8.20618,-7.03,-3.22,-6.18647256213236
C[C@H](NC(=O)[C@H]1Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C3CCCCC3)C[C@H]12)c1ccccc1,C35871554_decoy,WEE1,Decoy,0.0,-8.45149,-9.72,-1.48,-9.43769423536414
C[C@@H](NC(=O)[C@H]1Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C3CCCCC3)C[C@H]12)c1ccccc1,C35871555_decoy,WEE1,Decoy,0.0,-8.51308,-8.65,-3.16,-7.616316525026762
CC(C)c1ccc(NC(=O)[C@H](C2CCCC2)[NH+]2CCN(C(=O)c3ccc(C(C)(C)C)cc3)CC2)cc1,C36311730_decoy,WEE1,Decoy,0.0,-8.88224,-7.9,-3.46,-7.961966356309256
CC(C)c1ccc([C@H](c2c(NC(=O)c3ccco3)sc3c2CCCC3)N2CC[NH+](C)CC2)cc1,C38546516_decoy,WEE1,Decoy,0.0,-7.40503,-7.33,-3.31,-6.121160400541284
C[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)[C@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1,C38574741_decoy,WEE1,Decoy,0.0,-9.35304,-8.94,-1.53,-2.831437819058725
Cc1c(OCc2ccccc2)ccc2c1OC1(CC[NH+](CC(=O)Nc3ccc(F)cc3)CC1)CC2=O,C39227146_decoy,WEE1,Decoy,0.0,-9.73553,-8.51,-3.33,-8.931874072127723
COc1ccc([C@H](c2c(NC(C)=O)sc3c2CCCC3)[NH+]2CCC(Cc3ccccc3)CC2)cc1,C39853481_decoy,WEE1,Decoy,0.0,-8.6534,-8.06,-0.9,-6.706785109104636
O=C(N[C@H]1CCc2ccccc21)C1CC[NH+](Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)CC1,C41251280_decoy,WEE1,Decoy,0.0,-6.55281,-6.87,-1.9,-5.200110198339063
C=C1CCC[C@@]2(C)C[C@H]3OC(=O)[C@H](C[NH+]4CCC[C@@H]4C(O)(c4ccccc4)c4ccccc4)[C@H]3C[C@H]12,C43746539_decoy,WEE1,Decoy,0.0,-9.96513,-5.88,-3.03,-5.20768344076492
CCc1cc2c(cc1[C@H]1CSC[C@@H](C(=O)N3CCN(Cc4ccccc4)CC3)[NH2+]1)C(C)(C)CCC2(C)C,C44164431_decoy,WEE1,Decoy,0.0,-11.0346,-8.53,-3.27,-7.901242626120835
CC1CCN(c2ccc([C@@H](C)NC(=O)C3CC[NH+](Cc4ccc(Cl)cc4Cl)CC3)cc2)CC1,C44854004_decoy,WEE1,Decoy,0.0,-9.50811,-7.76,-1.32,-7.182395624642851
C[C@@H](NC(=O)[C@H]1CCC[NH+](Cc2ccc(Br)cc2)C1)c1ccc(N2CCCCC2)cc1,C44854699_decoy,WEE1,Decoy,0.0,-9.23888,-6.86,-2.19,-6.182471165853078
C[C@H]1CCCN(c2ccc([C@@H](C)NC(=O)C3CC[NH+](Cc4ccc(Br)cc4)CC3)cc2)C1,C44854961_decoy,WEE1,Decoy,0.0,-10.1439,-7.63,-2.24,-6.709552287357687
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)C1CC[NH+](Cc2ccc(Br)cc2)CC1,C44855391_decoy,WEE1,Decoy,0.0,-9.71052,-7.01,-2.54,-6.914903562429672
C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCC[NH+](Cc4ccc(Br)cc4)C3)cc2)C1,C44855767_decoy,WEE1,Decoy,0.0,-8.87446,-7.89,-1.61,-6.439632244642066
O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH+](Cc2ccc(Br)cc2)C1,C44910617_decoy,WEE1,Decoy,0.0,-9.73744,-8.88,-2.69,-8.052490330406634
Cc1cc(F)ccc1[C@H]1C[NH2+]CCN1C(=O)N1CCC=C[C@H]1c1cc(C(F)(F)F)cc(C(F)(F)F)c1,C45339203_decoy,WEE1,Decoy,0.0,-5.57237,-5.51,-3.41,-3.150326331952163
C[C@H]1CCc2c(sc3nc([C@H](C)[NH+]4CCCN(c5ccc(C(F)(F)F)cn5)CC4)[nH]c(=O)c23)C1,C45470684_decoy,WEE1,Decoy,0.0,-9.37859,-9.35,-2.92,-8.994928894528114
C[C@@H]1CN(C(=O)[C@H]2CN(c3cccc[nH+]3)C[C@@H]2c2ccc(F)cc2F)C[C@H](C)C1(O)c1ccccc1,C49066665_decoy,WEE1,Decoy,0.0,-8.30716,-5.84,-2.19,-5.356942207970692
CC[C@@H](C)N1C(=O)[C@H](Cc2ccccc2)[NH2+]C12CCN(S(=O)(=O)c1ccc(Cl)cc1)CC2,C36027282_decoy,WEE1,Decoy,0.0,-7.78234,-8.68,-3.15,-7.213312650748437
CC(C)C[C@@H]1[NH2+]C2(CCN(C(=O)c3cccc(F)c3)CC2)N(Cc2cccc(C(F)(F)F)c2)C1=O,C36032537_decoy,WEE1,Decoy,0.0,-7.6375,-7.59,-4.4,-5.769938574038942
CC[C@@H]1CCCCN1C(=O)C1=CC2=[NH+][C@H](c3ccc(Cl)c(Cl)c3)C[C@@H](C(F)(F)F)N2N1,C12850440_decoy,WEE1,Decoy,0.0,-9.25782,-6.45,-3.02,-5.798203767974523
CN1C(=O)/C(=C/c2ccccc2F)Sc2ccc(C(=O)NCCC3=c4ccccc4=[NH+]C3)cc21,C63467762_decoy,WEE1,Decoy,0.0,-9.63331,-9.75,-2.33,-11.604118951049454
COc1ccc2c(c1)=C1CCN[C@H](c3ccc(OCc4ccc(Cl)c(Cl)c4)c(OC)c3)[C@@H]1[NH+]=2,C63526316_decoy,WEE1,Decoy,0.0,-9.50159,-9.64,-3.2,-4.958879205449268
O=S(=O)(/N=C1\N=c2ccccc2=[NH+][C@H]1NCc1ccc(F)cc1)c1cc(Cl)ccc1Cl,C38970847_decoy,WEE1,Decoy,0.0,-7.95592,-9.53,-2.78,-8.039749128959674
Cc1ccc2c(c1)=C(NC(=O)c1ccc(Cl)cc1)[C@H](C(=O)N1CCN(c3ccccc3)CC1)[NH+]=2,C63752565_decoy,WEE1,Decoy,0.0,-9.65091,-9.22,-2.1,-9.37175196364782
Cc1ccc(S(=O)(=O)/N=C2\N=c3ccccc3=[NH+][C@H]2Nc2cc(Cl)cc(Cl)c2)cc1C,C38975725_decoy,WEE1,Decoy,0.0,-9.70218,-10.6,-1.82,-9.550769914951308
C[NH+]1CCC2(CC1)N=C(SCC(=O)Nc1ccc(F)cc1F)C(c1ccc(C(C)(C)C)cc1)=N2,C35397150_decoy,WEE1,Decoy,0.0,-8.58143,-9.44,-1.69,-8.224692285348777
COc1ccccc1N1CCN(c2ccc(NC(=O)C3CC3)cc2C(=O)N[C@@H](C)c2ccccc2)CC1,C00746682_decoy,WEE1,Decoy,0.0,-9.77882,-6.94,-1.74,-6.639983514148176
Cc1ccc([C@H](NC(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)C(Cl)(Cl)Cl)cc1F,C03187039_decoy,WEE1,Decoy,0.0,-9.41696,-5.56,-1.69,-4.968560965170608
CCOC(=O)c1c(NC(=S)Nc2c(C)n(C)n(-c3ccccc3)c2=O)sc2c1CCCCCC2,C02853633_decoy,WEE1,Decoy,0.0,-10.1253,-8.06,-4.05,-8.281438681154595
COC(=O)C1=C(N)N(c2ccc(Br)cc2)C2=C(C(=O)CC(C)(C)C2)[C@@H]1c1ccc(OC)cc1,C02188618_decoy,WEE1,Decoy,0.0,-7.66213,-4.45,-1.57,-4.472012705360212
Cc1ccc(-c2nc3ncccc3o2)cc1NC(=S)NC(=O)c1cccc(I)c1,C08739042_decoy,WEE1,Decoy,0.0,-8.86051,-9.05,-2.88,-8.446701154595164
C[C@@H]1O[C@@H](NC(=O)c2ccc(Br)cc2)[C@@H](NC(=O)c2ccc(Br)cc2)O[C@H]1C,C08781320_decoy,WEE1,Decoy,0.0,-9.00945,-5.38,-1.98,-6.011099468683327
CC(C)(C)c1ccc(C(=O)NC(=S)Nc2ccc(N3CCN(C(=O)c4ccccc4)CC3)cc2)cc1,C08896813_decoy,WEE1,Decoy,0.0,-9.18363,-8.54,-2.03,-8.495898088056528
CSc1ncc(Br)c(C(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCC3)n1,C08915217_decoy,WEE1,Decoy,0.0,-10.74,-8.43,-1.75,-9.892474350147667
CSc1ncc(Br)c(C(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCC3)n1,C08915218_decoy,WEE1,Decoy,0.0,-10.8511,-8.2,-0.78,-10.009847757466542
COC(=O)NC(=O)c1c(NC(=O)c2ccccc2I)sc2c1CC[C@@H](C)C2,C09298138_decoy,WEE1,Decoy,0.0,-8.31071,-9.85,-1.46,-10.846256885600994
COC(=O)NC(=O)c1c(NC(=O)c2ccccc2I)sc2c1CC[C@H](C)C2,C09298139_decoy,WEE1,Decoy,0.0,-10.1439,-8.46,-1.05,-9.253566400659118
CCOC(=O)NC(=O)c1c(NC(=O)c2ccccc2I)sc2c1CCCCC2,C09298508_decoy,WEE1,Decoy,0.0,-10.3125,-8.07,-4.29,-9.136621596843511
O=C(NC(=S)Nc1cccc(-c2nc3ncccc3o2)c1)c1cccc(I)c1,C01408540_decoy,WEE1,Decoy,0.0,-9.54038,-7.96,-4.1,-7.53249282634121
CC(C)CCN1C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(F)cc3)[C@@]3(C)C=C[C@@]2(O3)[C@@H]1C(=O)NC1CCCCC1,C09490678_decoy,WEE1,Decoy,0.0,-8.40734,-5.1,-4.3,-5.392938169497832
Cc1ccc2nc(NS(=O)(=O)CCNC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)sc2c1,C09523010_decoy,WEE1,Decoy,0.0,-9.10246,-9.52,-2.99,-8.798359053645491
CC(C)[C@@H](NC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1)c1cccs1,C10853112_decoy,WEE1,Decoy,0.0,-10.955,-10.01,-3.71,-11.457867537493955
COc1ccc([C@@H]2[C@H](C(=O)c3ccc(F)cc3)N3c4ccccc4C=C[C@@H]3[C@@]2(C#N)C(N)=O)cc1OC,C12371259_decoy,WEE1,Decoy,0.0,-7.00065,-6.03,-3.3,-4.792920991443891
COc1ccc(/C=C/C(=O)NNC(=O)COc2c(C)cc(Br)cc2Br)cc1,C12490620_decoy,WEE1,Decoy,0.0,-8.54884,-8.14,-2.27,-6.961331540734178
COC(=O)c1c(NC(=S)NC(=O)COc2ccc(Br)cc2C)sc2c1CCCC2,C12499753_decoy,WEE1,Decoy,0.0,-9.9498,-7.51,-2.65,-9.285941104973434
CC(C)(C)NC(=O)[C@H]1N(CCC2=CCCCC2)C(=O)[C@@H]2[C@@H](C(=O)NCc3cccs3)[C@H]3C=C[C@]21O3,C12642721_decoy,WEE1,Decoy,0.0,-9.48767,-8.47,-2.57,-9.274235243947592
CC(C)CNC(=O)C1CCN(C(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)cc2)CC1,C13352952_decoy,WEE1,Decoy,0.0,-10.074,-10.92,-3.88,-9.560013006455552
COc1ccc(Br)cc1C(=O)NC(=S)Nc1cccc(C(=O)N(C)c2ccccc2)c1,C13621509_decoy,WEE1,Decoy,0.0,-9.34102,-9.51,-2.11,-9.15893191335528
COc1cc([C@@H]2Nc3ccc(S(=O)(=O)NC4CCCCC4)cc3[C@H]3C=CC[C@@H]32)cc(OC)c1OC,C13640613_decoy,WEE1,Decoy,0.0,-9.39679,-9.02,-4.03,-8.22601277179519
O=C(CSc1ccc(NC(=O)c2cccs2)nn1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1,C13805999_decoy,WEE1,Decoy,0.0,-7.3923,-8.26,-2.77,-9.737247963550177
CC(C)(C)C(=O)N1CCN(c2ccc(NC(=S)NC(=O)C(c3ccccc3)c3ccccc3)cc2)CC1,C13946251_decoy,WEE1,Decoy,0.0,-7.81728,-8.16,-2.44,-7.383724444356493
O=C(NC(=S)Nc1ccc(N2CCN(C(=O)c3ccccc3)CC2)c(Cl)c1)c1ccc(Cl)cc1,C14276967_decoy,WEE1,Decoy,0.0,-9.46032,-8.99,-3.05,-6.544967780850056
COc1ccc([C@H]2[C@@H](C(=O)c3ccccc3)N3c4ccc(F)cc4C=C[C@H]3[C@@]2(C#N)C(N)=O)cc1OC,C15023230_decoy,WEE1,Decoy,0.0,-8.09003,-6.51,-3.05,-6.271004993561734
COc1ccc([C@H]2[C@H](C(=O)c3ccccc3)N3c4ccc(F)cc4C=C[C@H]3[C@@]2(C#N)C(N)=O)cc1OC,C15023235_decoy,WEE1,Decoy,0.0,-8.01127,-5.75,-1.76,-4.819175281574906
C[C@H](NC(=O)C(=O)NCc1ccc(F)cc1)[C@@H](c1cccs1)N1CCN(c2ccccc2F)CC1,C23181319_decoy,WEE1,Decoy,0.0,-8.47736,-7.65,-2.44,-7.218131597884899
Cc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@](CC1CCCCC1)(C(=O)[O-])[NH2+][C@H]2c1cccc(C(F)(F)F)c1,C33598414_decoy,WEE1,Decoy,0.0,-6.70361,-7.61,-2.86,-7.739309343774105
CC[C@@H](C)[C@@]1(C(=O)[O-])[NH2+][C@@H](c2ccc(/C=C/c3ccccc3)cc2)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@@H]21,C34388371_decoy,WEE1,Decoy,0.0,-7.7252,-5.11,-1.61,-4.194145611514241
C[C@H]1CCc2c(sc(NC(=O)c3sc4ccccc4c3Cl)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C34988619_decoy,WEE1,Decoy,0.0,-10.1465,-10.47,-2.22,-10.263094450285443
O=C(NCc1cccc(C(F)(F)F)c1)[C@H]1CCCN(C(=O)c2csc(Nc3ccccc3F)n2)C1,C35593878_decoy,WEE1,Decoy,0.0,-9.49565,-10.35,-3.51,-9.046152219875555
O=C(Nc1cccc([C@@H]2OC(=O)N(Cc3ccccc3)[C@@H]2C(=O)Nc2ccccc2)c1)c1cccs1,C35754417_decoy,WEE1,Decoy,0.0,-8.31647,-9.18,-4.59,-7.989673128762621
C/C(=N\NC(=O)[C@@]1(C)CC1(Br)Br)c1ccc(NC(=O)c2ccc(C)o2)cc1,C08455976_decoy,WEE1,Decoy,0.0,-8.22333,-8.31,-0.93,-7.065286132232704
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2CCNC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc1,C38560748_decoy,WEE1,Decoy,0.0,-8.83759,-8.85,-4.3,-6.327362164279855
N#CC1=C(N)Oc2cc(OC(=O)COc3c(F)c(F)c(F)c(F)c3F)ccc2[C@@H]1c1ccc(F)cc1,C38653209_decoy,WEE1,Decoy,0.0,-8.55227,-10.53,-1.62,-7.913084577852678
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/c3ccccc3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C39836471_decoy,WEE1,Decoy,0.0,-10.086,-9.91,-4.59,-9.4343231462301
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/c3ccccc3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C39836473_decoy,WEE1,Decoy,0.0,-10.4001,-10.06,-0.2,-17.371489825823325
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3cccc(Cl)c3)c2C(=O)N[C@@H]2CCS(=O)(=O)C2)C1,C39836544_decoy,WEE1,Decoy,0.0,-9.96091,-9.63,-2.06,-10.814780394885783
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3cccc(Cl)c3)c2C(=O)N[C@H]2CCS(=O)(=O)C2)C1,C39836545_decoy,WEE1,Decoy,0.0,-10.2744,-10.42,-1.22,-10.432491550622307
O=C(Cc1ccccc1)Nc1cccc([C@H]2OC(=O)N(Cc3ccccc3)[C@H]2C(=O)Nc2ccccc2)c1,C40406545_decoy,WEE1,Decoy,0.0,-8.04475,-6.27,-2.2,-6.078787545677558
CC(C)c1ccc([C@H](CNC(=O)c2ccc(NS(C)(=O)=O)cc2)N2CCc3sccc3C2)cc1,C46846201_decoy,WEE1,Decoy,0.0,-10.7147,-10.49,-2.31,-9.326398578049073
C[C@H](NC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1ccccc1,C35166881_decoy,WEE1,Decoy,0.0,-8.72628,-5.87,-3.12,-6.0475194569253725
Cc1cc2nn(-c3ccccc3)nc2cc1NC(=S)NC(=O)c1ccc(I)cc1,C59437518_decoy,WEE1,Decoy,0.0,-9.56576,-8.16,-2.27,-8.194680433311357
O=C(CSc1nc2ccc(/N=C/c3cc(Br)ccc3O)cc2s1)NC[C@H]1CCCO1,C59474834_decoy,WEE1,Decoy,0.0,-11.6351,-9.12,-1.55,-9.231147694281674
CCOC(=O)c1c(NC(=O)CSC2=NC(=O)C[C@@H](c3ccccc3)N2)sc2c1CCCCCC2,C59941741_decoy,WEE1,Decoy,0.0,-9.78177,-8.94,-1.9,-9.812262902254927
COc1ccccc1C[NH+]1CCC(NC(=O)c2ccc(S(=O)(=O)[N-]c3ccc(F)cc3)cc2)CC1,C62566729_decoy,WEE1,Decoy,0.0,-8.95584,-9.85,-1.81,-10.022494436562017
CC(C)(C)NC(=O)CSC1=NC(=O)C[C@H](c2cc(Br)c(O)c(Br)c2)[C@@H]1C#N,C64136861_decoy,WEE1,Decoy,0.0,-8.96203,-8.49,-1.76,-7.883850489810836
CCC(=O)Nc1ccc(S(=O)(=O)N2CCc3ccccc3[C@H]2CC(=O)NCc2cccs2)cc1,C64928204_decoy,WEE1,Decoy,0.0,-9.30559,-7.1,-3.47,-7.098231495962291
O=C(c1ccccc1)[C@@H]1[C@@H](C(=O)c2ccccc2)[C@@]2(C(=O)Nc3ccccc32)[C@H]2c3ccccc3C=C[NH+]12,C08914333_decoy,WEE1,Decoy,0.0,-7.68124,-6.31,-3.03,-4.291434144412955
Cc1ccc(Cl)cc1N1CC[NH+]([C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1,C09512139_decoy,WEE1,Decoy,0.0,-9.10627,-7.94,-1.7,-6.248695594992223
CN(C1CC1)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC[NH+](Cc2ccccc2)C3)cc1,C10100400_decoy,WEE1,Decoy,0.0,-11.2685,-9.82,-2.06,-9.466900572992802
O=C(CSc1nnc(C[NH+]2CCCCC2)n1-c1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1,C09881944_decoy,WEE1,Decoy,0.0,-8.65254,-8.94,-1.97,-8.0920585968257
Cc1cccc(C)c1NC(=O)CN(C)C(=O)C[NH+]1CC2(CCCC2)c2cc3c(cc2[C@H]1C)OCCO3,C11286290_decoy,WEE1,Decoy,0.0,-8.61597,-6.63,-3.18,-5.807834870407501
CC[NH+]1CCN(c2ccc(NC(=O)C3CCN(S(=O)(=O)c4ccc(C)c(C)c4)CC3)cc2C)CC1,C11323729_decoy,WEE1,Decoy,0.0,-10.1026,-9.18,-2.97,-13.264698341560443
C[C@H](NC(=O)c1cc(F)ccc1F)c1nnc2n1CC[NH+](Cc1ccc(OC(F)(F)F)cc1)CC2,C11996065_decoy,WEE1,Decoy,0.0,-9.4253,-8.65,-3.09,-7.701921117639717
Cc1cc(I)ccc1NC(=O)C[NH+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2,C12881564_decoy,WEE1,Decoy,0.0,-10.0289,-5.4,-1.55,-5.146431639223707
Cc1cc(I)ccc1NC(=O)C[NH+](Cc1ccco1)[C@H]1CCS(=O)(=O)C1,C12913118_decoy,WEE1,Decoy,0.0,-8.84112,-7.84,-2.58,-8.982927170960474
Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C(=O)c3ccc4c(c3)OCCO4)CC2)c(Br)c1,C14329256_decoy,WEE1,Decoy,0.0,-9.13588,-5.87,-3.41,-4.940325294708709
O=S1(=O)CC[C@H]([NH2+]Cc2cc3cc4c(cc3nc2OCc2cccc(C(F)(F)F)c2)CCC4)C1,C14986166_decoy,WEE1,Decoy,0.0,-8.87018,-10.21,-4.2,-8.920009482732862
C/C(=N/NC(=O)C[NH+]1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1)c1ccc(C)cc1,C19826291_decoy,WEE1,Decoy,0.0,-8.3364,-8.35,-4.53,-8.213277896210805
Cc1ccc(NC(=O)c2cccc(S(=O)(=O)N3CC[NH+](C)CC3)c2)cc1I,C21050687_decoy,WEE1,Decoy,0.0,-9.60816,-6.78,-0.39,-7.493186530017894
C[NH+]1CCN([C@@H](CNc2nc(-c3cccnc3)nc3sc4c(c23)CCCC4)c2cccs2)CC1,C22917274_decoy,WEE1,Decoy,0.0,-11.4251,-5.66,-2.86,-7.001206158392901
C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)[NH+]1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1,C25152205_decoy,WEE1,Decoy,0.0,-8.74981,-10.31,-2.81,-9.153610878116304
CCNC(=O)c1ccc(C(=C2C[C@H]3CC[C@@H](C2)[NH+]3Cc2ccccn2)c2ccc(C(=O)N(C)C)cc2)cc1,C28396934_decoy,WEE1,Decoy,0.0,-7.59744,-7.89,-4.34,-7.388698587121556
O=C(C1CCN(c2cc[nH+]cc2)CC1)N1CC[C@@H](CNS(=O)(=O)/C=C/c2ccc(Cl)s2)C1,C28955946_decoy,WEE1,Decoy,0.0,-10.5984,-7.34,-2.02,-7.37536437933467
COc1ccc(NC(=O)[C@@H]2Cc3cc(C(F)(F)F)ccc3N3CCN(c4cccc[nH+]4)C[C@H]23)cc1OC,C35545040_decoy,WEE1,Decoy,0.0,-8.75188,-6.55,-2.97,-5.093184562498575
CC[C@@H](Oc1ccc2c(c1)[C@H](c1ccccc1)N(C(=O)c1ccccc1)CC2)C(=O)N1CC[NH2+][C@H](C)C1,C35858967_decoy,WEE1,Decoy,0.0,-6.99227,-8.53,-1.91,-6.359641258446572
CCC(=O)N1CCc2ccc(OCc3ccc(C(=O)N4CC[NH2+][C@H](C)C4)o3)cc2[C@H]1c1cccc(F)c1,C35863309_decoy,WEE1,Decoy,0.0,-9.53764,-11.22,-4.7,-11.72910303387681
COc1ccc([C@H](CNC(=O)CN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)[NH+]2CCCCC2)cc1,C38615207_decoy,WEE1,Decoy,0.0,-9.80921,-8.35,-1.68,-11.196468163858432
O=C([C@@H]1CC=CC[C@H]1C(=O)N1CCC(O)(c2ccc(Cl)cc2)CC1)N1CCN(c2cccc[nH+]2)CC1,C38733490_decoy,WEE1,Decoy,0.0,-9.86174,-5.27,-2.04,-6.08409504385437
CC1(C)C[C@@H](NC(=O)[C@H]2CCC[NH+](Cc3nc(-c4ccc(C(C)(C)C)cc4)no3)C2)c2ccccc2O1,C38903358_decoy,WEE1,Decoy,0.0,-9.75517,-10.45,-3.15,-8.204228038710076
O=C(NCc1ccccc1C(F)(F)F)[C@H]1CC12CC[NH+](C[C@@H]1C=NN=C1c1ccc(F)cc1)CC2,C39354725_decoy,WEE1,Decoy,0.0,-8.98373,-5.84,-2.05,-5.670125978167912
O=[P@]1(Cc2ccccc2)N[NH+]2C[C@@H]3C=C(S(=O)(=O)Oc4ccccc4)C(F)=C[C@@H]3C[C@@H]2CO1,C39466763_decoy,WEE1,Decoy,0.0,-7.32953,-6.24,-4.34,-4.934310000478862
O=[P@@]1(Cc2ccccc2)N[NH+]2C[C@@H]3C=C(S(=O)(=O)Oc4ccccc4)C(Cl)=C[C@@H]3C[C@@H]2CO1,C39466804_decoy,WEE1,Decoy,0.0,-8.45907,-5.95,-1.19,-5.845950213247095
O=[P@@]1(S(=O)(=O)Oc2ccccc2)N[NH+]2C[C@@H]3C=C(Cc4ccccc4)C(F)=C[C@H]3C[C@H]2CO1,C39469716_decoy,WEE1,Decoy,0.0,-7.56447,-7.0,-0.99,-5.122227472480979
CC(C)Cc1cc(I)ccc1N1CC[NH2+][C@H](S(=O)(=O)Oc2ccccc2)C1,C39529487_decoy,WEE1,Decoy,0.0,-8.72084,-7.99,-2.65,-8.528926881240574
COC(=O)[C@@H]1CC2=C3CC=CC=C3N=C2[C@H]2C[C@@H]([NH+]3CC[C@@H](O)C3)C[C@@H](c3ccc(SC)cc3)N21,C39560807_decoy,WEE1,Decoy,0.0,-9.00715,-5.57,-1.44,-4.354256167170188
C[C@H](C(=O)Nc1ccccc1F)[NH+]1CCN(CC2=NC(=O)C3=C(c4cccs4)CSC3=N2)CC1,C39733319_decoy,WEE1,Decoy,0.0,-10.9406,-5.83,-2.69,-5.812140853516596
CCN(CC)C(=O)C1=C(C)[NH+]=C2SCCCN2[C@@H]1c1cccc(NC(=O)c2cccc(OC)c2)c1,C40368168_decoy,WEE1,Decoy,0.0,-8.10373,-5.97,-3.95,-5.432865319752793
CCN(CC)C(=O)C1=C(C)[NH+]=C2SCCCN2[C@H]1c1cccc(NC(=O)c2cccc(OC)c2)c1,C40368169_decoy,WEE1,Decoy,0.0,-9.46311,-4.81,-3.09,-5.53982136811289
O=C(NC1CC[NH+](Cc2nc(-c3cccc(C(F)(F)F)c3)no2)CC1)c1cc2c(s1)CCCC2,C40960757_decoy,WEE1,Decoy,0.0,-9.65877,-8.92,-5.15,-7.276573058012006
Cc1ccc([C@H](CNC(=O)c2nn([C@@H]3CCS(=O)(=O)C3)c3c2CCCC3)[NH+]2CCCCCC2)cc1,C40988795_decoy,WEE1,Decoy,0.0,-8.6505,-9.53,-2.11,-8.478932108011705
COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)[C@H]1CCC[NH+](Cc2ccc(Cl)cc2)C1,C44939183_decoy,WEE1,Decoy,0.0,-9.55865,-8.65,-3.42,-8.474065510794084
O=C(N[C@@H]1CCCC[C@H]1OCc1ccccc1)[C@H]1CC=CC[C@H]1C(=O)N1CCN(c2cccc[nH+]2)CC1,C44944179_decoy,WEE1,Decoy,0.0,-9.15665,-7.34,-2.91,-6.702138595065765
C[C@H]1CCCC[NH+]1Cc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1,C46809215_decoy,WEE1,Decoy,0.0,-9.20963,-7.87,-3.36,-7.490686972935311
[NH2+]=C1/C(=C\c2cccn2-c2ccc(Br)cc2)C(=O)N=C2SC(Cc3ccccc3)=NN12,C20211200_decoy,WEE1,Decoy,0.0,-9.67207,-5.89,-2.2,-5.627399244792585
O=C(CN1CCN(Cc2cc(=O)n3ccsc3[nH+]2)CC1)N[C@H](c1ccc(F)cc1)c1cccs1,C22809938_decoy,WEE1,Decoy,0.0,-11.3291,-9.05,-2.37,-8.774870744418607
CC1(C)C[C@@H]2C[C@@](C)(C[NH+]2CN2C(=O)/C(=N\NC(=O)c3ccncc3)c3cc(Br)ccc32)C1,C20568368_decoy,WEE1,Decoy,0.0,-9.50836,-9.21,-1.66,-9.3029473122321
C=CCNC(=O)c1ccccc1N1C(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@H]3[C@H](c3ccc(C)cc3)N2C1=O,C63374180_decoy,WEE1,Decoy,0.0,-8.3082,-9.53,-4.25,-8.50847481002727
CC(C)C[C@@H](C(=O)N[C@@H]1CCCc2ccccc21)N1C(=O)N2CCC3=c4ccccc4=[NH+][C@@H]3[C@@]2(C)C1=O,C63374663_decoy,WEE1,Decoy,0.0,-8.36764,-7.96,-1.68,-6.555039646029883
C=CCNC(=O)c1ccccc1N1C(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@H]3[C@H](c3ccccc3C)N2C1=O,C63375392_decoy,WEE1,Decoy,0.0,-7.80203,-5.6,-1.84,-4.368919673393727
COC(=O)[C@@H]1[NH+]=c2ccc(Br)cc2=C1NC(=O)[C@H](C)N1CCN(c2cccc(C)c2C)CC1,C63540994_decoy,WEE1,Decoy,0.0,-8.66533,-9.14,-1.04,-9.89374942377448
COc1ccccc1N1CCN(C(=O)[C@H]2[NH+]=c3ccc(C)cc3=C2NC(=O)c2ccc(F)cc2)CC1,C63752799_decoy,WEE1,Decoy,0.0,-9.37942,-8.74,-3.81,-8.810975132318134
CC[NH2+][C@@H]1CC(=O)N([C@H]2C[C@H]3CC[C@]2(CS(=O)(=O)N2CCC4(CCc5ccccc54)CC2)C3(C)C)C1=O,C28227859_decoy,WEE1,Decoy,0.0,-8.97564,-9.07,-3.34,-8.590990015990103
Cc1ccc(-c2nc(C)c(C(=O)N3CCC([C@@H](C)C(=O)NCCN4CC[NH+](C)CC4)CC3)s2)cc1,C65006615_decoy,WEE1,Decoy,0.0,-9.65042,-8.2,-3.89,-8.24287141174934
Cc1ccc(NC(=O)C2CCN(c3c(C(=O)N4CCCCC4)c[nH+]c4snc(C)c34)CC2)c(C)c1,C65301129_decoy,WEE1,Decoy,0.0,-9.49054,-9.23,-0.92,-9.177833211856708
CCc1ccc(NC(=O)C2CCN(c3c(C(=O)N4CCC(C)CC4)c[nH+]c4snc(C)c34)CC2)cc1,C65301166_decoy,WEE1,Decoy,0.0,-8.72524,-7.03,-3.91,-7.787455040708253
Cc1ccc(NC(=O)C2CCN(c3c(C(=O)N4CCC(C)CC4)c[nH+]c4snc(C)c34)CC2)cc1C,C65301190_decoy,WEE1,Decoy,0.0,-9.66173,-10.13,-1.65,-9.599440143047817
COc1ccc(NS(=O)(=O)c2cccc(C(=O)N/N=C/c3cc(C)n(-c4ccc(C)cc4)c3C)c2)cc1,C03318397_decoy,WEE1,Decoy,0.0,-8.54477,-9.33,-2.11,-7.467015942483461
Cc1ccc(S(=O)(=O)N(C)c2ccccc2C(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)cc1,C02852761_decoy,WEE1,Decoy,0.0,-6.94062,-8.57,-4.19,-6.714055889050592
COc1ccc([C@H]2C(C#N)=C(N)N(c3sc4c(c3C#N)CCCCC4)C3=C2C(=O)CC(C)(C)C3)cc1OC,C02188801_decoy,WEE1,Decoy,0.0,-9.32061,-5.6,-2.92,-5.740369110668946
COC(=O)[C@@H](NC(=O)CO/N=C1\C=C[C@@]2(C)C(=C1)CC[C@H]1[C@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O)c1ccccc1,C08770073_decoy,WEE1,Decoy,0.0,-8.89003,-6.46,-1.8,-6.636819259954049
Cc1cc(C)c2oc(-c3cccc(NC(=S)NC(=O)c4ccc(N5CCCC5)c([N+](=O)[O-])c4)c3)nc2c1,C08833160_decoy,WEE1,Decoy,0.0,-9.3607,-10.19,-2.39,-9.20885726768246
COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(N3CCN(C(=O)c4ccc(C)cc4)CC3)cc2)cc1,C08897694_decoy,WEE1,Decoy,0.0,-9.94059,-8.58,-2.98,-7.162448475258865
CCC(=O)N1CCc2cc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)Nc3nc4ccc(C)cc4s3)ccc21,C09692226_decoy,WEE1,Decoy,0.0,-9.11016,-8.73,-2.46,-7.874717483460873
CCC(=O)N1CCc2cc(S(=O)(=O)N[C@H](CC(C)C)C(=O)Nc3nc4ccc(C)cc4s3)ccc21,C09692227_decoy,WEE1,Decoy,0.0,-9.26567,-9.26,-1.72,-10.568865999769129
Cc1ccc(NC(=O)[C@@H]2[C@H]3C(=O)N(Cc4ccccc4F)[C@H](C(=O)NC4CCCCC4)[C@]34C=C[C@H]2O4)cc1,C03658606_decoy,WEE1,Decoy,0.0,-8.93472,-6.17,-3.14,-5.931366649410205
COc1cc(NC(=O)C2CCN(C(=O)c3ccc(Cl)cc3)CC2)c(OC)cc1NC(=O)c1ccccc1,C11096072_decoy,WEE1,Decoy,0.0,-9.10109,-9.2,-3.62,-7.939645024410878
COc1cc([C@@H](C(=O)NC2CCCC2)N(C(=O)c2ccc3c(c2)OCCO3)c2ccc(C)cc2)ccc1O,C12637886_decoy,WEE1,Decoy,0.0,-8.94334,-6.48,-2.64,-6.920440472733112
CC(=O)Nc1ccc(N(C(=O)Cn2nnc3ccccc32)[C@H](C(=O)NC2CCCC2)c2ccccc2C)cc1,C13029503_decoy,WEE1,Decoy,0.0,-7.04782,-8.14,-2.78,-7.276956684087753
N#CC1=C(N)n2c(s/c(=C\c3ccc(-c4ccccc4)o3)c2=O)=C(C#N)[C@@H]1c1ccc(-c2ccccc2)o1,C08951207_decoy,WEE1,Decoy,0.0,-8.97486,-9.23,-3.2,-6.64338994695505
COc1cc(/C=C2/CCCC3=C2OC(N)=C(C#N)[C@@H]3c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC,C13881913_decoy,WEE1,Decoy,0.0,-10.2519,-8.18,-1.33,-10.228628832546606
COc1cc([C@@H]2Nc3ccc(S(=O)(=O)Nc4cc(C)cc(C)c4)cc3[C@H]3C=CC[C@@H]32)ccc1OC(C)=O,C14468569_decoy,WEE1,Decoy,0.0,-8.58915,-9.07,-3.61,-7.102549665608998
Cc1ccc(C(=O)N2CCN(c3ccc(NC(=S)NC(=O)c4cccc(OC(C)C)c4)cc3)CC2)cc1,C16293283_decoy,WEE1,Decoy,0.0,-8.59674,-9.13,-2.06,-7.14183649706323
COc1cc([C@H]2Nc3ccc(S(=O)(=O)Nc4ccc(C)c(C)c4)cc3[C@H]3C=CC[C@H]32)cc(OC)c1OC,C16312552_decoy,WEE1,Decoy,0.0,-10.0564,-10.27,-2.93,-13.743799193624522
CC[C@@H](C)[C@@H](NS(=O)(=O)c1c(C)cc(C)cc1C)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C16608660_decoy,WEE1,Decoy,0.0,-8.45185,-7.03,-1.19,-6.480936036979771
CC[C@H](C)[C@H](NS(=O)(=O)c1c(C)cc(C)cc1C)C(=O)Nc1nnc(-c2ccc3c(c2)OCO3)s1,C16608666_decoy,WEE1,Decoy,0.0,-9.36638,-7.72,-2.81,-6.8172899597018
CC(C)[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)N/N=C\c1ccc(Br)c([N+](=O)[O-])c1,C30961647_decoy,WEE1,Decoy,0.0,-8.67427,-9.03,-1.5,-8.62941560694235
O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CCC2)NNC(=O)c1ccccc1F,C32910360_decoy,WEE1,Decoy,0.0,-10.1583,-8.44,-2.24,-7.171578672611572
CC(C)CCN1C(=O)[C@H]2[C@@H](C(=O)Nc3ccc(Cl)cc3)[C@H]3C=C[C@@]2(O3)[C@H]1C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C,C33767465_decoy,WEE1,Decoy,0.0,-9.262,-5.99,-3.42,-6.819163174173981
CC[C@@H](C)[C@H](NC(=O)Nc1ccccc1Br)C(=O)N1CCN(C(=O)CCC2CCCC2)[C@H](C)C1,C34998817_decoy,WEE1,Decoy,0.0,-9.27942,-8.66,-3.81,-7.907755989789739
CC[C@H](C)[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)N1CCN(C(=O)NC(C)C)[C@H](C)C1,C35098011_decoy,WEE1,Decoy,0.0,-7.09031,-9.12,-4.62,-7.0517030512676735
COC(=O)[C@H](Cc1ccccc1)NC(=O)CO/N=C1\C=C[C@@]2(C)C(=C1)CC[C@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(C)O,C35361523_decoy,WEE1,Decoy,0.0,-10.2086,-8.65,-2.07,-9.2277753603453
O=C(Nc1nnc(-c2ccc3c(c2)OCO3)s1)[C@H]1CCCN1C(=O)Nc1cccc(Br)c1,C35729464_decoy,WEE1,Decoy,0.0,-8.72049,-10.46,-2.01,-11.778022475424205
CCCN(CC(=O)Nc1ccc(N2CCN(C(=O)Nc3cccc(C)c3)CC2)cc1)C(=O)c1ccccc1,C36013493_decoy,WEE1,Decoy,0.0,-8.65114,-7.03,-3.51,-6.037535761224763
O=C(Nc1ccc(N2CCN(C(=O)NC3CCCCC3)CC2)c(C(=O)N2CCCCC2)c1)c1ccccc1F,C36019607_decoy,WEE1,Decoy,0.0,-8.36618,-9.91,-2.47,-9.734818548006343
CC(C)(C)c1ccc(C(=O)NNC(=O)[C@H]2O[C@H]3OC4(CCCCC4)O[C@@H]3[C@H]3OC4(CCCCC4)O[C@@H]32)cc1,C36185372_decoy,WEE1,Decoy,0.0,-7.21242,-11.54,-2.01,-9.730010079595877
Cc1cccc(CN2C(=O)O[C@H](c3ccc(NC(=O)c4cccs4)cc3)[C@H]2C(=O)NCc2ccco2)c1,C36217383_decoy,WEE1,Decoy,0.0,-8.5331,-5.89,-3.69,-5.058782491366067
C[C@@H](NC(=O)[C@@H]1[C@H](c2cccc(NC(=O)c3ccccc3)c2)OC(=O)N1Cc1ccccc1)c1ccccc1,C36218529_decoy,WEE1,Decoy,0.0,-8.31452,-9.14,-3.61,-8.141936792873189
Cc1cccc(C(=O)Nc2cccc([C@H]3OC(=O)N(Cc4ccccc4)[C@@H]3C(=O)Nc3cccc(F)c3)c2)c1,C36218732_decoy,WEE1,Decoy,0.0,-8.91825,-10.08,-4.14,-8.15171820056634
Cc1cccc(C(=O)Nc2cccc([C@@H]3OC(=O)N(Cc4ccccc4)[C@@H]3C(=O)Nc3cccc(F)c3)c2)c1,C36218733_decoy,WEE1,Decoy,0.0,-7.71666,-10.06,-2.72,-8.864529341948668
O=C(Nc1cccc([C@H]2OC(=O)N(Cc3ccccc3)[C@H]2C(=O)NCc2ccccc2)c1)c1ccccc1F,C36221249_decoy,WEE1,Decoy,0.0,-8.00196,-8.46,-4.01,-9.440235945098545
COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cc(OC)c(OC)c(OC)c2)cc1Cl,C38700419_decoy,WEE1,Decoy,0.0,-8.33103,-9.3,-1.6,-7.786444401693542
CC(=O)O[C@H]1CCC2=C(CC(=O)N[C@H]3[C@@]2(O)C(=O)C(=O)[C@]2(C)[C@H]([C@@H](C)CCCC(C)C)CC[C@@]32C)C1(C)C,C35339757_decoy,WEE1,Decoy,0.0,-8.47062,-5.74,-2.82,-6.288941084785135
CCOC(=O)C1=C(CSc2nc3c(cc2C#N)CN(C)CC3)OC(N)=C(C#N)[C@@H]1c1ccc(C(C)C)cc1,C39328010_decoy,WEE1,Decoy,0.0,-7.98191,-8.65,-2.11,-8.254012906342302
Cc1c(C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CC[C@@H](C(C)(C)C)C3)oc2ccccc12,C39836557_decoy,WEE1,Decoy,0.0,-9.16173,-11.13,-1.96,-9.932690030086972
Cc1cc(C)c2c(CC(=O)Nc3sc4c(c3C(=O)N[C@@H]3CCS(=O)(=O)C3)CC[C@@H](C)C4)coc2c1,C39883672_decoy,WEE1,Decoy,0.0,-10.3795,-10.4,-2.6,-10.397464940151655
O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@@H]3C2)c([N+](=O)[O-])c1,C16362029_decoy,WEE1,Decoy,0.0,-7.06505,-9.94,-2.08,-6.955641886953723
Cc1cccc(Cn2nc(C)c(NC(=S)Nc3ccc(S(=O)(=O)N4[C@@H](C)CCC[C@@H]4C)cc3)c2C)c1,C39974389_decoy,WEE1,Decoy,0.0,-8.33257,-8.71,-3.99,-7.230107527331262
Cc1nn(Cc2cccc(F)c2)c(C)c1NC(=S)Nc1ccc(S(=O)(=O)N2[C@H](C)CCC[C@H]2C)cc1,C39974402_decoy,WEE1,Decoy,0.0,-9.78667,-8.0,-2.89,-7.593208519697006
N#C/C(=C\c1cccc(Oc2ccccc2)c1)C(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2,C39992669_decoy,WEE1,Decoy,0.0,-10.8375,-9.72,-2.09,-15.421251808478011
CCc1ccc2oc(C(=O)Nc3sc4c(c3C(=O)N[C@H]3CCS(=O)(=O)C3)CC[C@@H](C)C4)c(C)c2c1,C40038074_decoy,WEE1,Decoy,0.0,-9.79153,-10.85,-2.96,-10.513991729810542
O=C(CN1CCN(C(=O)c2csc(NC3CCCCC3)n2)CC1)NC(c1ccccc1)c1ccccc1,C40427371_decoy,WEE1,Decoy,0.0,-11.0159,-9.43,-3.7,-9.121127070551578
CCOC(=O)c1ccc(NC(=O)c2oc3c(c2C)/C(=N/NS(=O)(=O)c2ccc(F)cc2)CCC3)cc1,C40826138_decoy,WEE1,Decoy,0.0,-9.8306,-8.66,-1.55,-10.234059834290935
COc1ccc([C@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)Nc4cccc(C(F)(F)F)c4)c3N2)cc1OC,C00866077_decoy,WEE1,Decoy,0.0,-9.2835,-9.74,-4.43,-9.253801422442402
CC(C)(C)[C@H]1CCc2c(sc(NC(=S)NC(=O)c3cc([N+](=O)[O-])ccc3N3CCOCC3)c2C#N)C1,C22861037_decoy,WEE1,Decoy,0.0,-10.6468,-8.71,-1.58,-14.263654958630967
CC(C)(C)[C@@H]1CCc2c(sc(NC(=S)NC(=O)c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c2C#N)C1,C59331666_decoy,WEE1,Decoy,0.0,-8.91584,-9.12,-1.29,-8.73591653965445
CCc1ccc(CNC(=O)C[C@@H]2c3ccccc3CCN2S(=O)(=O)c2cc(C)ccc2NC(C)=O)cc1,C64928269_decoy,WEE1,Decoy,0.0,-8.16787,-6.71,-3.13,-5.539384588950406
COC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)sc2c1CC[NH+](C(C)C)C2,C03007134_decoy,WEE1,Decoy,0.0,-9.5118,-10.29,-2.8,-8.201240518277793
N#Cc1c(Cl)[nH+]c(N2CCN(C(=O)NS(=O)(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(Cl)c1Cl,C03770997_decoy,WEE1,Decoy,0.0,-9.46513,-6.78,-1.69,-6.7936288174869
COc1ccc(-c2cc(C[C@H]3C[NH2+]CC[C@H]3CC(=O)N3CCc4cc(OC)c(OC)cc4C3)no2)cc1,C08623718_decoy,WEE1,Decoy,0.0,-9.88411,-9.19,-1.93,-8.906414702407268
Cc1cc2cc([C@@H](c3nnnn3C3CCCC3)[NH+](Cc3cccnc3)Cc3ccco3)c(O)nc2cc1C,C08670971_decoy,WEE1,Decoy,0.0,-9.26927,-6.21,-3.4,-5.260803361075314
O=C(Nc1ccc(Cl)cc1)[C@@H]1[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2[C@@H]2c3ccccc3C=C[NH+]12,C09019127_decoy,WEE1,Decoy,0.0,-8.1563,-5.55,-2.94,-5.4788427166619735
COc1c2c(cc3c1[C@@H](CC(=O)C1=CC[C@@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]14C)[NH+](C)CC3)OCO2,C09033668_decoy,WEE1,Decoy,0.0,-10.0947,-8.32,-2.62,-12.208441199064069
CCOC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cc2)sc2c1CC[NH+](C)C2,C09391449_decoy,WEE1,Decoy,0.0,-10.3691,-9.19,-1.46,-8.849167810127552
Cc1nc(N2CCN(c3cccc[nH+]3)CC2)c2c(C)c(C(=O)Nc3ccc4c(c3)OCCO4)sc2n1,C02911877_decoy,WEE1,Decoy,0.0,-8.734,-7.34,-3.0,-5.589081773727424
O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CC[NH+](C34CC5CC(CC(C5)C3)C4)CC2)c1,C12428860_decoy,WEE1,Decoy,0.0,-9.33535,-10.39,-1.42,-8.601431996747326
Cc1ccc(-c2ccc(C(=O)NC[C@@H]3C[C@H]4C=C[C@@H]3C43CC3)c(N3CCC([NH+]4CCC(O)CC4)CC3)n2)s1,C19955546_decoy,WEE1,Decoy,0.0,-10.6955,-6.59,-1.12,-10.330774763893098
C[NH+]1C[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)C[C@H]1c1nc(-c2ccc(OC(F)(F)F)cc2)no1,C20464134_decoy,WEE1,Decoy,0.0,-7.91265,-8.95,-1.32,-9.69401914024678
CCOc1ccc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])cc1C[NH+]1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2,C20616199_decoy,WEE1,Decoy,0.0,-8.62487,-10.54,-2.31,-9.601056426553123
COc1cc(C[NH2+]Cc2ccc3c(c2)OCO3)cc(Br)c1OCc1ccc2c(c1)OCCO2,C20876875_decoy,WEE1,Decoy,0.0,-9.29189,-6.55,-3.38,-5.781956968455136
O=c1c2c3c(sc2nc(N/N=C/c2ccc(F)cc2)n1-c1ccccc1)C[NH+](Cc1ccccc1)CC3,C26954125_decoy,WEE1,Decoy,0.0,-8.19839,-7.48,-2.14,-5.669130839291806
COc1ccc(-c2noc(C[NH+]3CCC(C(=O)N[C@@H]4CC(C)(C)Oc5ccc(OC)cc54)CC3)n2)cc1,C30981008_decoy,WEE1,Decoy,0.0,-9.68882,-9.04,-3.59,-7.554844126840184
O=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)C1CC[NH+](Cc2nc(-c3ccc(F)cc3)no2)CC1,C30982458_decoy,WEE1,Decoy,0.0,-9.58342,-9.52,-3.45,-8.006103508067323
COC(=O)c1c(NC(=O)[C@@H]2CCC[NH+](Cc3nc(-c4cccc(Cl)c4)no3)C2)sc2c1CCCC2,C31052492_decoy,WEE1,Decoy,0.0,-10.072,-7.85,-4.44,-8.058389236536426
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)N4CC[NH+](C5C6CC7CC(C6)CC5C7)CC4)cc3N2)cc1OC,C00719918_decoy,WEE1,Decoy,0.0,-8.90596,-8.55,-2.72,-6.934633043293289
COc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)N4CC[NH+](C5C6CC7CC(C6)CC5C7)CC4)cc3N2)cc1OC,C00719919_decoy,WEE1,Decoy,0.0,-10.0375,-9.6,-4.41,-8.497000258125915
CCc1c(C)sc2nc(SCC(=O)N(C)C)nc(N3CC[NH+](CC(=O)NC4CCCCC4)CC3)c12,C34762337_decoy,WEE1,Decoy,0.0,-11.0898,-7.22,-1.13,-11.381810038077605
COc1ccc(NC(=O)N2CCN(c3nc(C[NH+](C)C)nc4sc5c(c34)CCCC5)CC2)c(OC)c1,C35525653_decoy,WEE1,Decoy,0.0,-10.0033,-6.49,-1.84,-8.018390039524963
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)c3ccc(F)cc3)CC2)N(C)C(=O)N[C@H]1c1ccc(F)cc1,C35642682_decoy,WEE1,Decoy,0.0,-7.18453,-5.78,-2.91,-5.175708417611538
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)c3ccc(F)cc3)CC2)N(C)C(=O)N[C@H]1c1ccc(C)cc1C,C35646702_decoy,WEE1,Decoy,0.0,-8.36501,-5.34,-3.27,-4.9942817507203525
Cc1cc(N2CC[NH+](Cc3ccc4c(c3)OCO4)CC2)nc(SCc2ccc(C(=O)NC(C)C)o2)n1,C36038924_decoy,WEE1,Decoy,0.0,-10.1008,-9.39,-5.43,-8.676549822813767
CCOc1ccc2nc(NC(=O)C[NH+]3CCC(n4nnc5cc(C(F)(F)F)ccc54)CC3)sc2c1,C08828659_decoy,WEE1,Decoy,0.0,-8.68403,-9.28,-1.94,-7.928611756746463
Cc1ccc(S(=O)(=O)N2CCN(C(=O)C3=CC4=[NH+][C@@H](C5(C)CC5)C[C@@H](C(F)(F)F)N4N3)CC2)cc1,C01332966_decoy,WEE1,Decoy,0.0,-8.29723,-9.02,-2.65,-11.440456773227288
C[NH+]1CCN(c2nc3ccc(NC(=O)[C@@H]4CCCN(S(=O)(=O)c5cccs5)C4)cc3s2)CC1,C38511483_decoy,WEE1,Decoy,0.0,-10.9949,-9.19,-2.49,-13.765017005431432
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2ccc3nc(N4CC[NH+](C)CC4)sc3c2)cc1,C38884774_decoy,WEE1,Decoy,0.0,-8.79018,-9.66,-1.64,-7.521629293200673
COc1ccc(-c2noc(C[NH+]3CCC[C@@H](C(=O)N[C@@H](C)c4ccc(N5CCC(C)CC5)cc4)C3)n2)cc1,C38892985_decoy,WEE1,Decoy,0.0,-10.0117,-9.1,-2.66,-8.651759439974349
COc1ccc(-c2noc(C[NH+]3CCC[C@H](C(=O)N[C@@H]4CC(C)(C)Oc5ccc(C)cc54)C3)n2)cc1OC,C38893656_decoy,WEE1,Decoy,0.0,-9.90766,-9.11,-2.97,-8.714236575588558
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC[NH+](Cc2nc(-c3ccc(Br)cc3)no2)C1,C38905308_decoy,WEE1,Decoy,0.0,-8.16404,-8.83,-3.31,-7.105025972650905
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCC[NH+](Cc2nc(-c3ccc(Br)cc3)no2)C1,C38905309_decoy,WEE1,Decoy,0.0,-7.7048,-8.94,-2.64,-6.371905049558087
CC(C)Oc1cccc([C@@H]2[NH+]=NC(=S)N2/N=C/c2cc(Br)cc(Br)c2O)c1,C38966302_decoy,WEE1,Decoy,0.0,-10.4644,-7.2,-1.18,-8.261676720488538
CC(C)Oc1cccc([C@H]2[NH+]=NC(=S)N2/N=C/c2cc(Br)cc(Br)c2O)c1,C38966303_decoy,WEE1,Decoy,0.0,-9.49729,-9.55,-1.14,-9.737507159137763
CCOC1=C[C@@H]2C[C@H]3CO[P@](=O)(Cc4ccccc4)N[NH+]3C[C@@H]2C=C1S(=O)(=O)Oc1ccccc1,C39466934_decoy,WEE1,Decoy,0.0,-9.09278,-6.81,-2.69,-5.578892886202064
CCc1cc(S(=O)(=O)Oc2ccccc2)ccc1N1CC[NH2+][C@@H](S(=O)(=O)Oc2ccccc2)C1,C39528938_decoy,WEE1,Decoy,0.0,-9.87055,-6.19,-4.27,-6.779811362070717
O=C(NCc1ccc(-c2ccccn2)s1)[C@@H]1CN(C(=O)c2ccc3ccccc3c2)CC12CC[NH2+]CC2,C39677619_decoy,WEE1,Decoy,0.0,-9.69109,-8.67,-2.13,-7.16477504906979
COc1ccccc1C[C@H](C)NC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CC12CC[NH2+]CC2,C39686562_decoy,WEE1,Decoy,0.0,-9.61255,-7.46,-2.27,-7.113374567309334
C[C@H](Cc1ccccc1F)NC(=O)[C@H]1CN(C(=O)c2cccc3c2-c2ccccc2C3=O)CC12CC[NH2+]CC2,C39686865_decoy,WEE1,Decoy,0.0,-8.88269,-10.99,-2.06,-11.21617260878358
Cc1cc(C)c2c(CC(=O)N/N=C3\CCCc4oc(C(=O)N(C)C5CC[NH+](C)CC5)c(C)c43)coc2c1,C40826839_decoy,WEE1,Decoy,0.0,-9.22675,-10.52,-2.24,-8.787436990687711
COc1ccc2ccc(F)c(CC(=O)N3CCO[C@H](C[NH2+]Cc4cccc(-c5ccc(F)cc5)n4)C3)c2n1,C45231073_decoy,WEE1,Decoy,0.0,-8.34872,-9.33,-2.34,-7.783395758176426
COc1cc(/C=C2/C(=[NH2+])N3C(SCC(C)C)=NSC3=NC2=O)cc(Cl)c1OC(=O)c1ccco1,C20154868_decoy,WEE1,Decoy,0.0,-9.67224,-8.55,-3.23,-7.862470170402362
COc1ccc(-n2cccc2/C=C2\C(=[NH2+])N3N=C(COc4ccccc4C)SC3=NC2=O)cc1Cl,C32964323_decoy,WEE1,Decoy,0.0,-10.0049,-9.47,-1.77,-7.410143361958636
CC[C@H](C)[C@H]1[NH2+]C2(CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)N(Cc2cccnc2)C1=O,C36029881_decoy,WEE1,Decoy,0.0,-8.71557,-9.66,-3.79,-8.946708980147447
O=C(CSc1nnc(-c2cccc([N+](=O)[O-])c2)o1)Nc1ccccc1N1CC[NH+](C2CCCCC2)CC1,C35077695_decoy,WEE1,Decoy,0.0,-8.86573,-10.05,-2.22,-9.591298895055653
CCCCC[C@H](C)NC(=O)c1ccccc1N1C(=O)N2CCC3=c4cc(OC)ccc4=[NH+][C@H]3[C@@]2(C)C1=O,C63361821_decoy,WEE1,Decoy,0.0,-8.27769,-7.41,-2.83,-7.248517281166415
COc1ccc2c(c1)=C1CCN3C(=O)N(c4ccccc4C(=O)N[C@H](C)CCCC(C)C)C(=O)[C@]3(C)[C@H]1[NH+]=2,C63361858_decoy,WEE1,Decoy,0.0,-8.03819,-6.97,-1.4,-6.688322585282063
O=C(NCc1ccco1)c1ccccc1N1C(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@@H]3[C@@H](c3ccccc3)N2C1=O,C63375301_decoy,WEE1,Decoy,0.0,-7.22439,-6.26,-2.47,-5.661462809636283
O=C(NC[C@@H]1CCCO1)c1ccccc1N1C(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@@H]3[C@@H](c3ccccc3)N2C1=O,C63375353_decoy,WEE1,Decoy,0.0,-8.16358,-5.63,-2.53,-5.274173276664939
C=CCNC(=O)c1ccccc1N1C(=O)[C@@H]2CC3=c4ccccc4=[NH+][C@@H]3[C@@H](c3ccc(OC)cc3)N2C1=O,C63376103_decoy,WEE1,Decoy,0.0,-7.52934,-5.37,-3.28,-5.399913194665028
COCCNC(=O)[C@@H](C)[C@@H]1CC[C@@]2(C)Cc3sc(CS(=O)(=O)C(C)(C)C)nc3[C@@H](C)[C@@H]2[C@H]1O,C03840683_decoy,WEE1,Decoy,0.0,-10.6667,-5.33,-5.2,-4.724376982370163
CN(c1ccc(Br)cc1)S(=O)(=O)c1ccc2[nH]cc(C(=O)NC3CCCC3)c(=O)c2c1,C06296742_decoy,WEE1,Decoy,0.0,-9.70409,-6.05,-2.28,-5.629346766646326
Cc1ccc2oc(C(=O)Nc3sc4c(c3C(=O)N[C@@H]3CCS(=O)(=O)C3)CC[C@H](C)C4)c(C)c2c1,C09280971_decoy,WEE1,Decoy,0.0,-8.93971,-10.26,-1.74,-9.553137350610369
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)sc2c1CC[C@H](C)C2,C12064259_decoy,WEE1,Decoy,0.0,-9.08618,-9.18,-2.7,-9.87809284749954
CNC(=O)c1c(NC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2)sc2c1CCCCC2,C12064317_decoy,WEE1,Decoy,0.0,-10.7014,-9.91,-3.84,-8.596932353925974
CCOC(=O)c1c(NC(=O)CSC2=C(C#N)[C@@H](c3cccs3)CC(=O)N2)sc2c1CCCC2,C03277147_decoy,WEE1,Decoy,0.0,-10.3072,-8.18,-2.97,-8.9710228883146
C[C@]12C=C[C@]3(O1)[C@H](C(=O)N(C[C@@H]1CCCO1)[C@@H]3C(=O)NC1CCCCC1)[C@@H]2C(=O)NC1CCCCC1,C12642171_decoy,WEE1,Decoy,0.0,-9.12476,-6.11,-2.14,-5.61878918830012
O=C(Nc1ccccc1F)[C@@H]1[C@H]2C(=O)N(Cc3cccs3)[C@H](C(=O)NCc3ccccc3)[C@]23C=C[C@H]1O3,C01380905_decoy,WEE1,Decoy,0.0,-8.85019,-6.63,-4.02,-6.128058028904299
CC(=O)N[C@H](Cc1cccc(C)c1)C(=O)NC1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1,C13565560_decoy,WEE1,Decoy,0.0,-7.89908,-8.8,-2.87,-7.7949326931935055
CC(=O)N[C@H](Cc1ccccc1C)C(=O)NC1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1,C13565754_decoy,WEE1,Decoy,0.0,-7.58659,-9.35,-4.88,-7.157563539974295
COc1ccccc1NC(=O)c1ccc(NC(=O)CSc2nn(-c3ccccc3)c(=S)s2)cc1,C02649451_decoy,WEE1,Decoy,0.0,-9.34117,-9.79,-2.4,-7.906148166880535
CC(C)C(=O)N1CCN(c2ccc(NC(=S)NC(=O)/C=C/c3ccc(-c4ccccc4)o3)cc2)CC1,C16574914_decoy,WEE1,Decoy,0.0,-9.01672,-8.11,-1.72,-7.79598420782788
CCCCOC(=O)c1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Br)cc2)cc1,C16856623_decoy,WEE1,Decoy,0.0,-8.50547,-6.68,-1.62,-8.611547911351366
CCOC(=O)C1=c2/c(=C/c3ccc(F)cc3)c(N)c(C(=O)OCC)n2C(=O)[C@H](c2ccc(F)cc2)S1,C20167907_decoy,WEE1,Decoy,0.0,-8.42694,-6.63,-1.16,-7.522638617834096
CCOC(=O)C1=C(N)C(C(=O)OCC)=c2s/c(=C/c3ccccc3F)c(=O)n2[C@H]1c1ccccc1F,C20459080_decoy,WEE1,Decoy,0.0,-7.50683,-4.93,-2.37,-5.635236829419066
O=C(NC(=S)Nc1cc(Cl)ccc1N1CCN(C(=O)C(F)(F)F)CC1)c1cc2ccccc2o1,C20499149_decoy,WEE1,Decoy,0.0,-8.48399,-9.28,-1.01,-9.699207932882132
N/C(=N\OC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1)c1cccc(Br)c1,C20534240_decoy,WEE1,Decoy,0.0,-8.5212,-10.33,-2.16,-8.211849176490828
CCOC(=O)c1c(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)sc2c1CCCC2,C06146150_decoy,WEE1,Decoy,0.0,-9.74721,-9.33,-1.09,-9.9814235415361
C=CCn1c(SCC(=O)NNC(=O)c2ccc(Cl)cc2)nnc1-c1ccc(Br)cc1,C20923064_decoy,WEE1,Decoy,0.0,-8.58789,-8.32,-1.86,-10.571056518996691
CC(C)CNC(=O)[C@H]1CCCN(C(=O)c2ccc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2)C1,C21706985_decoy,WEE1,Decoy,0.0,-8.97893,-10.14,-3.13,-8.76047772451399
Cc1ccc(NC(=O)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCN(c3ccccc3)CC2)c(C)c1,C22856382_decoy,WEE1,Decoy,0.0,-9.64114,-9.29,-1.9,-9.268213410649793
COc1ccc(NC(=O)/C(=C\c2ccc(OC)cc2OC)NC(=O)c2ccc(Br)cc2)cc1,C28310976_decoy,WEE1,Decoy,0.0,-8.88732,-6.32,-3.26,-6.608823503245003
O=C(Nc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)c1)c1cccs1,C30038387_decoy,WEE1,Decoy,0.0,-8.92847,-8.13,-3.56,-7.381330882730698
Cc1ccccc1C(=O)N1CCN(c2ccc(NC(=S)NC(=O)c3ccc4c(c3)OCO4)cc2)CC1,C32127331_decoy,WEE1,Decoy,0.0,-9.27875,-10.11,-2.89,-7.218887273043935
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@](CC2CCCCC2)(C(=O)[O-])[NH2+][C@@H]3/C=C/c2ccccc2)cc1,C33575115_decoy,WEE1,Decoy,0.0,-7.95122,-7.28,-4.59,-6.2347678785486735
CC[C@@H](C(=O)c1ccc(Br)cc1)[C@H]1[C@H](C(=O)NNC(=O)c2ccccc2)C(=O)OC1(C)C,C33821696_decoy,WEE1,Decoy,0.0,-8.53748,-7.0,-1.89,-7.912269445941105
CC(=O)N[C@@H]1[C@@H](Oc2ccccc2/C=C/C(=O)c2ccc(Cl)cc2)O[C@@H]2COC(C)(C)O[C@@H]2[C@@H]1O,C35056555_decoy,WEE1,Decoy,0.0,-7.66786,-9.57,-2.3,-9.323630101923074
CC[C@@H](C)[C@H](NC(=O)c1ccc(Br)cc1)C(=O)Nc1nnc(-c2ccc(N(C)C)cc2)s1,C35300569_decoy,WEE1,Decoy,0.0,-9.26272,-6.81,-1.45,-6.279135637422698
CNC(=O)C1=C(C)[NH+]=C2SCCCN2[C@H]1c1ccc([N-]S(=O)(=O)c2cccc3cccnc23)cc1,C35337832_decoy,WEE1,Decoy,0.0,-8.09018,-5.76,-2.94,-4.926308849907315
COc1cccc(CSc2nnc([C@H](C)NC(=O)Nc3c(C)cccc3C)n2-c2ccc(C)cc2)c1,C00736622_decoy,WEE1,Decoy,0.0,-8.3342,-8.27,-2.53,-7.485865974768868
O=C(Cc1ccccc1)Nc1cccc([C@H]2OC(=O)N(Cc3ccccc3)[C@H]2C(=O)Nc2ccc(F)cc2)c1,C35754818_decoy,WEE1,Decoy,0.0,-8.11152,-8.8,-3.77,-7.566104628034477
COC(=O)C1=C(N)N(c2ccccc2)C2=C(C(=O)[C@H](C(=O)OC)[C@@H](c3ccccc3)C2)[C@@H]1c1ccccc1F,C01422403_decoy,WEE1,Decoy,0.0,-8.63632,-5.05,-1.61,-5.229220512972365
O=C(N[C@@H](C(=O)NCc1ccco1)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1,C36212483_decoy,WEE1,Decoy,0.0,-8.56436,-10.14,-4.13,-8.73830172949867
Cc1ccc(C(=O)Nc2cccc([C@@H]3OC(=O)N(Cc4ccc(F)cc4)[C@@H]3C(=O)NCC3CC3)c2)cc1,C36218194_decoy,WEE1,Decoy,0.0,-7.25411,-8.97,-3.66,-6.372240290914941
O=C(Nc1cccc([C@@H]2OC(=O)N(Cc3ccccc3)[C@H]2C(=O)Nc2ccc(F)cc2)c1)c1cccs1,C36218362_decoy,WEE1,Decoy,0.0,-8.44409,-8.82,-4.38,-7.536092011082056
Cc1ccc(CN2C(=O)O[C@H](c3cccc(NC(=O)CC(C)C)c3)[C@@H]2C(=O)Nc2cccc(F)c2)cc1,C36219030_decoy,WEE1,Decoy,0.0,-8.35806,-6.33,-4.37,-5.8827262356418775
O=C(COc1ccccc1I)Nc1cccc(S(=O)(=O)/N=C2\CCCN2)c1,C36844753_decoy,WEE1,Decoy,0.0,-7.71495,-7.84,-2.78,-6.586925948009896
COC(=O)c1ccc([C@@H]2Nc3ccc(/C(C)=N/NC(=O)[C@@H](OC)c4ccccc4)cc3[C@H]3C=CC[C@@H]32)cc1,C08692066_decoy,WEE1,Decoy,0.0,-8.94532,-6.26,-2.56,-5.196207115889082
COC(=O)c1ccc([C@@H]2Nc3ccc(/C(C)=N/NC(=O)[C@H](OC)c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1,C08673002_decoy,WEE1,Decoy,0.0,-9.16518,-8.94,-2.76,-8.282709142278133
Cc1nn(Cc2ccc(F)cc2)c(C)c1NC(=S)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1,C39970884_decoy,WEE1,Decoy,0.0,-8.8147,-9.29,-2.81,-8.461358549106643
Cc1c(C(=O)Nc2sc3c(c2C(=O)N[C@H]2CCS(=O)(=O)C2)CC[C@H](C)C3)oc2ccc(F)cc12,C40038330_decoy,WEE1,Decoy,0.0,-9.47687,-11.07,-1.64,-9.282491887908249
C[C@@]1(C(=O)[O-])[NH2+][C@@H](c2cccc(Oc3cccc(C(F)(F)F)c3)c2)[C@H]2C(=O)N(C3CCCCC3)C(=O)[C@H]21,C43218578_decoy,WEE1,Decoy,0.0,-7.29255,-5.14,-1.51,-4.304838837586367
CC(=O)c1cccc(N2C(=O)[C@H]3[C@H](C(=O)Nc4ccccc4)[C@]4(C)C=C[C@]3(O4)[C@@H]2C(=O)NC(C)(C)C)c1,C12642276_decoy,WEE1,Decoy,0.0,-7.73236,-5.97,-2.98,-5.4708990565566245
O=C(C[C@@H]1C(=O)N(c2ccc(Cl)cc2)C(=S)N1NC(=O)c1ccccc1)Nc1cccc(Cl)c1,C33711409_decoy,WEE1,Decoy,0.0,-8.61038,-5.65,-4.23,-5.752988362455319
CNC(=S)N/C(=N\c1nc(C)cc(C)n1)N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1,C14161371_decoy,WEE1,Decoy,0.0,-9.37079,-6.89,-2.64,-6.280420019873981
Cc1ccc(C)c(NC(=S)N/C(=N\c2nc(C)cc(C)n2)N2CCN(c3ccc(Cl)cc3)CC2)c1,C14161302_decoy,WEE1,Decoy,0.0,-9.96332,-7.87,-3.03,-7.118332110923734
O=C(CSc1nnc(-c2ccc(Br)cc2)n1-c1ccccc1)NNC(=O)C(F)(F)F,C59777295_decoy,WEE1,Decoy,0.0,-6.7941,-8.97,-2.58,-6.843661005985318
O=C(Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1)[C@@H]1C(=O)N(Cc2ccco2)[C@H]2CCCCC2=C1O,C63426685_decoy,WEE1,Decoy,0.0,-11.0647,-9.74,-3.69,-7.0626756217435975
CC(=O)c1ccc(NC(=O)CSC2=NN[C@@H](C3=CC4=C(C)C(C)=N[C@H]4C=C3)N2Cc2ccccc2)cc1,C63730260_decoy,WEE1,Decoy,0.0,-10.1557,-10.26,,99.0
CC[C@@H]1Oc2cc(S(=O)(=O)N3CCC[C@H](C(=O)Nc4c(C)cc(C)cc4C)C3)c(C)cc2NC1=O,C35396638_decoy,WEE1,Decoy,0.0,-9.53672,-10.24,-3.08,-8.15578461718966
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)Nc3sc4c(c3C(N)=O)CC(C)(C)[NH2+]C4(C)C)cc2)C1,C04177854_decoy,WEE1,Decoy,0.0,-10.3019,-10.85,-3.01,-9.014509436865424
Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@H]3C(=O)NC3CC(C)(C)[NH2+]C(C)(C)C3)CC2)cc1,C09191427_decoy,WEE1,Decoy,0.0,-8.52784,-9.07,-3.58,-6.869200189063995
NC(=O)C1CCN(C(=O)C[NH+]2[C@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)C(=O)N[C@H]3CCCC[C@@H]32)CC1,C10384409_decoy,WEE1,Decoy,0.0,-10.0568,-8.94,-3.12,-6.400118856592726
NC(=O)C1CCN(C(=O)C[NH+]2[C@@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)C(=O)N[C@H]3CCCC[C@@H]32)CC1,C10384419_decoy,WEE1,Decoy,0.0,-10.1013,-8.36,-2.64,-8.646973681361246
COC(=O)[C@H]1[C@H]2C[C@H]3c4[nH]c5cc(OC)ccc5c4CC[NH+]3C[C@H]2C[C@H](OC(=O)c2ccc(N)cc2)[C@@H]1OC,C17287328_decoy,WEE1,Decoy,0.0,-8.03817,-6.45,-4.73,-5.605439105055527
COC(=O)[C@H]1[C@H]2C[C@H]3c4[nH]c5cc(OC)ccc5c4CC[NH+]3C[C@H]2C[C@@H](OC(=O)c2ccc(N)cc2)[C@@H]1OC,C17287336_decoy,WEE1,Decoy,0.0,-7.7624,-6.1,-3.03,-6.326044143192665
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C[NH+]3CCN(CCO)CC3)c2C(=O)Nc2ccc(Cl)cc2)C1,C22635342_decoy,WEE1,Decoy,0.0,-10.5256,-8.5,-2.21,-10.09185225016732
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12)c1cccc(Br)c1,C24986445_decoy,WEE1,Decoy,0.0,-8.45154,-6.64,-3.06,-5.549879778728339
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCC2(CC1)NCCc1[nH+]c[nH]c12)c1ccc(Br)cc1,C13571704_decoy,WEE1,Decoy,0.0,-10.1573,-6.77,-3.02,-5.649559548667659
CC(C)[NH+]1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4CCc5ccccc54)cc3)c2C(N)=O)C1,C11667734_decoy,WEE1,Decoy,0.0,-10.2191,-9.98,-0.84,-8.361196440648367
COC(=O)c1c(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)sc2c1CC(C)(C)[NH2+]C2(C)C,C36660260_decoy,WEE1,Decoy,0.0,-8.77909,-6.03,-2.94,-6.11561690937885
O=C(NCCc1c[nH]c2ccccc12)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39597648_decoy,WEE1,Decoy,0.0,-8.41631,-9.08,-1.8,-7.138881106867865
COc1ccc(C(=O)N2C[C@@H](C(=O)NCc3cc(F)cc(C(F)(F)F)c3)C3(CC[NH2+]CC3)C2)c(OC)c1,C39600261_decoy,WEE1,Decoy,0.0,-9.19034,-9.28,-2.7,-10.213960539642311
COc1ccccc1CCNC(=O)[C@@H]1CN(C(=O)c2ccc(Oc3ccccc3)nc2)CC12CC[NH2+]CC2,C39636389_decoy,WEE1,Decoy,0.0,-9.27283,-7.82,-2.26,-7.658493342506018
COc1cc(CCNC(=O)[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)cc(OC)c1,C39653014_decoy,WEE1,Decoy,0.0,-8.85028,-10.05,-3.62,-9.195389325430469
COc1cc(CCNC(=O)[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC23CC[NH2+]CC3)cc(OC)c1,C39653015_decoy,WEE1,Decoy,0.0,-8.80274,-7.37,-4.14,-6.616917184922418
Cc1ccc2[nH]cc(CCNC(=O)[C@@H]3CN(C(=O)c4ccc(OC(F)(F)F)cc4)CC34CC[NH2+]CC4)c2c1,C39655894_decoy,WEE1,Decoy,0.0,-7.95113,-8.42,-2.13,-6.650622526617631
COc1c(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4ccc(C)cc34)C3(CC[NH2+]CC3)C2)csc1Cl,C39656082_decoy,WEE1,Decoy,0.0,-10.5598,-5.77,-1.13,-5.507798097604253
C[C@H](NC(=O)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3O2)CC12CC[NH2+]CC2)c1ccc(Br)cc1,C39657100_decoy,WEE1,Decoy,0.0,-9.70063,-8.25,-1.29,-7.902344076974967
C[C@H](CNC(=O)[C@H]1CN(C(=O)c2cccnc2Oc2ccccc2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665315_decoy,WEE1,Decoy,0.0,-9.51036,-8.2,-2.55,-7.438214411823238
C[C@@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665390_decoy,WEE1,Decoy,0.0,-8.8602,-7.95,-2.3,-7.578054172820599
C[C@H](CNC(=O)[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC12CC[NH2+]CC2)Oc1ccccc1,C39665391_decoy,WEE1,Decoy,0.0,-7.35518,-6.58,-2.43,-4.541155556187317
COc1ccc(O[C@@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccccc3C(F)(F)F)CC23CC[NH2+]CC3)cc1,C39665566_decoy,WEE1,Decoy,0.0,-8.84337,-9.41,-4.65,-8.328594970611974
COc1ccc(O[C@H](C)CNC(=O)[C@H]2CN(C(=O)c3ccc(Br)cc3)CC23CC[NH2+]CC3)cc1,C39665650_decoy,WEE1,Decoy,0.0,-9.47408,-8.24,-1.84,-8.407585982511666
Cc1ccc(O[C@H](C)CNC(=O)[C@@H]2CN(C(=O)c3c(-c4ccccc4)noc3C)CC23CC[NH2+]CC3)cc1,C39666270_decoy,WEE1,Decoy,0.0,-8.88302,-6.71,-2.03,-7.756196794612674
CC1=C([C@@H](C)NC(=O)[C@@H]2CN(C(=O)c3cccc4c3-c3ccccc3C4=O)CC23CC[NH2+]CC3)[C@@H](C)N=N1,C39674206_decoy,WEE1,Decoy,0.0,-9.04845,-9.96,-2.17,-8.190456910290974
COc1ccc(C(NC(=O)[C@H]2CN(C(=O)c3ccccn3)CC23CC[NH2+]CC3)c2ccc(OC)cc2)cc1,C39676573_decoy,WEE1,Decoy,0.0,-9.50171,-7.88,-3.45,-9.13930605804014
C[C@H](Oc1ccccc1)C(=O)N1C[C@@H](C(=O)NCc2ccccc2N2CCCCC2)C2(CC[NH2+]CC2)C1,C39678284_decoy,WEE1,Decoy,0.0,-10.1852,-10.4,-3.92,-8.366983155726949
COc1c(C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)csc1Cl,C39684185_decoy,WEE1,Decoy,0.0,-10.2962,-7.88,-3.13,-8.213146954012915
COc1c(C(=O)N2C[C@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)csc1Cl,C39684186_decoy,WEE1,Decoy,0.0,-10.6088,-7.32,-1.65,-7.153095442339812
CC1=NN(C(C)(C)C)[C@H](C(=O)N2C[C@@H](C(=O)NCCc3c[nH]c4c(C)cccc34)C3(CC[NH2+]CC3)C2)C1,C39684187_decoy,WEE1,Decoy,0.0,-9.1129,-8.08,-2.8,-6.796578280018333
COc1ccccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC12CC[NH2+]CC2,C39686483_decoy,WEE1,Decoy,0.0,-9.45504,-9.46,-2.25,-8.675239033763155
COc1ccccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)c2ccc(OC)c(C(F)(F)F)c2)CC12CC[NH2+]CC2,C39686645_decoy,WEE1,Decoy,0.0,-7.77279,-7.47,-2.99,-6.10887976717943
Cc1ccc(C(=O)N2C[C@H](C(=O)N[C@@H](Cc3ccccc3)C(=O)N3CCCCC3)C3(CC[NH2+]CC3)C2)cc1F,C39687272_decoy,WEE1,Decoy,0.0,-7.79904,-10.29,-3.59,-8.357966876322235
O=C(CS[C@@H]1N[C@H]2SC3=C(CCCC3)[C@@H]2C(=O)N1c1ccccc1)N/N=C/C1=c2ccccc2=[NH+]C1,C39926557_decoy,WEE1,Decoy,0.0,-9.81239,-7.98,-2.01,-7.460127917071067
COc1ccccc1NC(=O)C1=C(C)[NH+]=C2SCCCN2[C@@H]1c1cccc(NC(=O)C2CCCC2)c1,C40368181_decoy,WEE1,Decoy,0.0,-10.0382,-9.32,-2.88,-9.6356560545062
NC(=O)C12CC3C[C@H](C1)C(NC(=O)C1([NH+]4CCN(c5ccc(C(F)(F)F)cn5)CC4)CCCC1)[C@@H](C3)C2,C36286336_decoy,WEE1,Decoy,0.0,-8.91579,-7.01,-3.45,-4.90966603442262
Cc1c(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)oc2c1/C(=N/NS(=O)(=O)c1ccc(F)cc1)CCC2,C40826240_decoy,WEE1,Decoy,0.0,-10.2917,-9.96,-4.99,-6.299499772034621
CCc1nc(-c2ccc(N3CCC[C@H](C(=O)N4CCC(C(N)=O)([NH+]5CCCCC5)CC4)C3)c(F)c2)no1,C40875872_decoy,WEE1,Decoy,0.0,-8.83373,-8.51,-3.13,-7.680622451884078
NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)[C@H]2CCCN(c3ccc(-c4noc(C5CC5)n4)cc3F)C2)CC1,C40877627_decoy,WEE1,Decoy,0.0,-10.2612,-8.52,-1.49,-8.030032085641537
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4ccccc4C(F)(F)F)CC34CC[NH2+]CC4)[nH]c2c1,C44737090_decoy,WEE1,Decoy,0.0,-8.1862,-8.02,-2.33,-7.106868720328842
Cc1ccc2nc([C@H](C)NC(=O)[C@@H]3CN(C(=O)c4ccc(-c5ccc(F)cc5)o4)CC34CC[NH2+]CC4)[nH]c2c1,C39695843_decoy,WEE1,Decoy,0.0,-9.64735,-7.03,-2.02,-6.642198510788279
Cc1ccc2nc([C@H](C)NC(=O)[C@H]3CN(C(=O)c4ccc(Cl)c(Cl)c4)CC34CC[NH2+]CC4)[nH]c2c1,C44736970_decoy,WEE1,Decoy,0.0,-9.489,-9.93,-2.69,-7.525592228820392
Cc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CN(C(=O)c4cccc(Br)c4)CC34CC[NH2+]CC4)[nH]c2c1,C39695722_decoy,WEE1,Decoy,0.0,-8.9069,-8.09,-1.54,-6.101498962896668
Cc1ccc2nc([C@@H](C)NC(=O)[C@H]3CN(C(=O)c4cccc(Br)c4)CC34CC[NH2+]CC4)[nH]c2c1,C44737114_decoy,WEE1,Decoy,0.0,-9.73775,-9.01,-2.65,-7.543307098146691
COc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o/c1=[NH+]\NS(=O)(=O)c1ccc(C)cc1,C59170739_decoy,WEE1,Decoy,0.0,-8.59749,-7.6,-2.14,-6.077239433078869
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](CC4=c5ccccc5=[NH+]C4)N[C@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1,C63480056_decoy,WEE1,Decoy,0.0,-7.78922,-6.33,-4.59,-4.848062030044089
O=C1[C@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2ccccc21,C63480119_decoy,WEE1,Decoy,0.0,-8.7991,-8.57,-1.82,-5.588382722963537
O=C1[C@@H]2[C@H](CC3=c4ccccc4=[NH+]C3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1,C63480122_decoy,WEE1,Decoy,0.0,-8.87535,-7.26,-1.34,-4.998867859159916
COc1cc([C@@H]2C(C#N)=C(N)OC3=C[C@H](C)N(CCc4c[nH]c[nH+]4)C(=O)[C@@H]32)cc(Br)c1OC,C53631891_decoy,WEE1,Decoy,0.0,-7.84861,-4.82,-1.62,-5.56598826311571
COc1cccc2c1N[C@@H](c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H](Sc3ccccc3[N+](=O)[O-])[C@@H](Cl)[C@H]21,C04045298_decoy,WEE1,Decoy,0.0,-6.97499,-11.33,-3.97,-9.072506287136072
Cc1ccc(S(=O)(=O)N(CC(=O)Nc2cccc(C(F)(F)F)c2)c2cccc([N+](=O)[O-])c2)cc1,C02845130_decoy,WEE1,Decoy,0.0,-7.03234,-8.26,-4.37,-7.176162926773572
CCOC(=O)c1ccccc1NC(=O)CSc1nnc2ccc(-c3ccc(Br)cc3)nn12,C09241161_decoy,WEE1,Decoy,0.0,-8.08033,-8.54,-1.67,-8.06450373151261
O=C(Nc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)cc1)c1cccc([N+](=O)[O-])c1,C11916732_decoy,WEE1,Decoy,0.0,-7.23757,-9.31,-5.33,-7.145048863120311
Cc1ccc(S(=O)(=O)N2CCN(c3ccc([N+](=O)[O-])c(NCc4ccc(C(C)C)cc4)c3)CC2)cc1,C08855098_decoy,WEE1,Decoy,0.0,-8.09018,2.38,-2.36,-2.6043725516090217
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2nc(-c3cc4ccc(OC)cc4o3)cs2)cc1,C13592431_decoy,WEE1,Decoy,0.0,-10.0087,-8.3,-1.62,-6.925810682592096
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(OC)c(O)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1,C01217095_decoy,WEE1,Decoy,0.0,-9.48255,-7.16,-2.44,-6.439149408815869
Cc1ccc(-c2nc3cc(Cl)ccc3o2)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1,C14277731_decoy,WEE1,Decoy,0.0,-8.82433,-9.04,-2.44,-6.634995916367364
Cc1ccc(/C(=N\NS(=O)(=O)c2ccccc2)[C@@H](Oc2ccccc2)n2nnc3ccccc32)cc1,C15776462_decoy,WEE1,Decoy,0.0,-8.56317,-9.4,-2.26,-8.68953248760967
Cc1ccc(-c2nnc(NC(=O)c3ccc(S(=O)(=O)N4CCCc5ccccc54)cc3)o2)c(C)c1,C16047610_decoy,WEE1,Decoy,0.0,-9.15572,-11.56,-1.36,-8.39572806912442
COCCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=S)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1,C16054892_decoy,WEE1,Decoy,0.0,-7.58217,-5.42,-1.61,-4.601867523698909
CC(C)CN(CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(Cl)cc1)C(=O)c1ccc2c(c1)OCO2,C00751145_decoy,WEE1,Decoy,0.0,-9.2907,-10.37,-3.98,-9.37784402988033
COc1ccc(C)cc1S(=O)(=O)N(CC(=O)Nc1ccc2c(c1)OCO2)c1ccc(C)c(C)c1,C16474294_decoy,WEE1,Decoy,0.0,-8.51644,-8.62,-3.32,-9.816792050291074
C[C@@H](NC(=O)c1ccc(Cl)cc1)c1nnc(SCc2ccc(F)cc2)n1-c1ccc([N+](=O)[O-])cc1,C16567619_decoy,WEE1,Decoy,0.0,-7.04479,-6.54,-2.32,-5.623254974954683
COc1ccc([C@H]2c3cccn3-c3ccccc3N2C(=O)CN(C(=O)Nc2ccccc2OC)C(C)C)cc1,C16569721_decoy,WEE1,Decoy,0.0,-5.76417,-5.17,-1.99,-5.007417806647168
O=C(/C=C/c1cccc([N+](=O)[O-])c1)Nc1ccc(N2CCN(C(=O)/C=C/c3ccccc3)CC2)cc1,C20528648_decoy,WEE1,Decoy,0.0,-8.69279,-11.4,-1.9,-8.722881370385059
CC(C)c1ccc(-c2nnc(NC(=O)c3ccc4c(c3)C(=O)N(Cc3ccco3)C4=O)s2)cc1,C21908147_decoy,WEE1,Decoy,0.0,-8.79263,-8.38,-2.7,-9.535275337079224
C=CCOC(=O)c1sc(NC(=O)[C@@H](C)Sc2nnc3cc(C)c4cc(C)cc(C)c4n23)nc1C,C32535259_decoy,WEE1,Decoy,0.0,-9.3645,-8.43,-3.13,-7.894605826508761
CCOC(=O)c1sc(NC(=O)[C@@H](C)Sc2nnc3cc(C)c4cc(C)cc(C)c4n23)nc1C,C32535255_decoy,WEE1,Decoy,0.0,-8.5698,-7.85,-2.1,-6.294224371298652
Cc1ccc(-c2noc(-c3cn(Cc4ccc(NS(=O)(=O)c5c(C)cc(C)cc5C)cc4)cn3)n2)cc1,C32974761_decoy,WEE1,Decoy,0.0,-8.6818,-9.72,-2.57,-7.896364021540698
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)noc2/C=C/c2cc(C)ccc2C)C1,C33250887_decoy,WEE1,Decoy,0.0,-9.28491,-10.13,-2.07,-9.599143176730664
Cc1ccc(-n2c(SCc3ccccc3C)nnc2[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1,C33779614_decoy,WEE1,Decoy,0.0,-8.00582,-8.46,-4.39,-6.835602639436994
CCCN(CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1)C(=O)c1ccc2c(c1)OCO2,C35136177_decoy,WEE1,Decoy,0.0,-8.99777,-9.49,-3.5,-10.79591577160602
CC(C)(C)c1ccc(C(=O)N2CCN(c3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)CC2)cc1,C35335624_decoy,WEE1,Decoy,0.0,-7.76264,-6.11,-3.57,-5.78721368046908
COc1cc(OC)cc(C(=O)Nc2ccc(-n3nc(OC(C)C)nc3-c3ccc(C)cc3)cc2)c1,C00693359_decoy,WEE1,Decoy,0.0,-7.38787,-8.89,-4.2,-6.766429294831579
COc1nc(-c2ccc3c(c2)OCO3)n(-c2ccc(NC(=O)C34CC5CC(CC(C5)C3)C4)cc2)n1,C35402420_decoy,WEE1,Decoy,0.0,-9.02204,-8.37,-2.11,-8.287140347116761
CC[C@@H](C)c1nc(N2CCN(C(=O)Nc3ccc(OC)cc3OC)CC2)c2c3c(sc2n1)CCCC3,C35867013_decoy,WEE1,Decoy,0.0,-8.73317,-7.64,-2.98,-7.023184991110648
COc1cc(NC(=O)N2CCN(c3nc(C(C)C)nc4sc5c(c34)CC[C@@H](C)C5)CC2)cc(OC)c1,C35867388_decoy,WEE1,Decoy,0.0,-10.278,-7.94,-2.47,-7.6162358236844305
Cc1ccc(CN(C(=O)C2CCCCC2)[C@H](C(=O)NC2CCCCC2)c2ccc([N+](=O)[O-])cc2)o1,C36555920_decoy,WEE1,Decoy,0.0,-8.46238,-7.48,-3.85,-7.392764750076465
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2nnc(-c3cc(Cl)sc3Cl)o2)cc1,C36630030_decoy,WEE1,Decoy,0.0,-10.9386,-9.08,-0.87,-15.496032402483376
CCC[C@H](C)c1nc(N2CCN(C(=O)NC3CCCCC3)CC2)c2c(C)nn(-c3ccc(F)cc3)c2n1,C37378007_decoy,WEE1,Decoy,0.0,-9.28186,-8.86,-2.82,-8.04558979237068
C[C@H](Oc1ccc(Cl)cc1Cl)c1nc(-c2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2)no1,C02848209_decoy,WEE1,Decoy,0.0,-9.90556,-8.82,-2.53,-7.00423925441586
COc1ccc(N2CCN([C@@H](c3ccccc3)c3sc4nc(-c5ccco5)nn4c3O)CC2)cc1,C22851811_decoy,WEE1,Decoy,0.0,-8.45627,-8.47,-3.46,-7.814020951475861
COc1ccc(C)cc1NC(=O)c1nnn(-c2ccc(C)cc2)c1CSc1nc(C)cc(C)n1,C38491256_decoy,WEE1,Decoy,0.0,-9.31631,-9.07,-1.66,-9.359715297821674
Cc1cccc2sc(NC(=O)CSc3nnc(-c4ccc5c(c4)OCO5)n3-c3ccccc3)nc12,C39750064_decoy,WEE1,Decoy,0.0,-9.92225,-9.48,-3.87,-8.195977001410412
CC1(C)[C@]2(C(=O)Nc3cc(Cl)ccc3Cl)CC[C@@]1(C)/C(=N/OC(=O)c1cccc([N+](=O)[O-])c1)C2,C33960462_decoy,WEE1,Decoy,0.0,-9.4083,-8.34,-2.62,-8.320323248939532
CCC(C)(C)[C@H]1CCc2c(sc(NC(=O)CSc3nnc(-c4ccc5c(c4)OCO5)n3C)c2C#N)C1,C39965417_decoy,WEE1,Decoy,0.0,-10.9847,-9.36,-0.95,-8.13181614191063
CCC[C@@]1(C)Cc2ccccc2-c2nc(N/N=C/c3ccc([N+](=O)[O-])cc3)n(-c3ccccc3)c(=O)c21,C40036116_decoy,WEE1,Decoy,0.0,-8.36361,-6.73,-1.98,-5.996875508321764
COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Oc4ccc(-c5ccc(C#N)cc5)cc4)c(C)c32)cc1,C40813879_decoy,WEE1,Decoy,0.0,-7.87101,-6.96,-2.68,-5.50264770338343
CCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccc(OCc2ccc(Br)cc2)cc1,C40921717_decoy,WEE1,Decoy,0.0,-9.26581,-8.55,-1.32,-9.331776446999562
O=C(Nc1sc2c(c1-c1nc(-c3ccccc3)no1)CCCC2)c1cc([N+](=O)[O-])ccc1Cl,C40993735_decoy,WEE1,Decoy,0.0,-9.66395,-10.04,-1.82,-9.033603393269145
CCc1ccc(C2=NN(c3ccccc3)[C@@]3(CC2)NN(c2cccc([N+](=O)[O-])c2)[C@H](C(C)=O)S3)cc1,C44590379_decoy,WEE1,Decoy,0.0,-8.06794,-5.51,-4.18,-5.439972785822554
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CCc1nc(-c2ccc(C(C)C)cc2)no1,C45772890_decoy,WEE1,Decoy,0.0,-10.0467,-8.77,-1.22,-14.024369271607313
COc1ccc(OC)c(N2CCN(CC(=O)Nc3ccc(-c4nc5ccc(C)cc5s4)cc3)C2=O)c1,C49391904_decoy,WEE1,Decoy,0.0,-8.40782,-8.8,-1.58,-6.979645063454969
COc1ccc(NC(=O)[C@H](C)Sc2nc(-c3ccc4c(c3)OCO4)cc(C(F)(F)F)n2)cc1OC,C58964194_decoy,WEE1,Decoy,0.0,-8.4189,-9.0,-1.97,-8.676399980800417
O=C(CSc1nc2ccccc2n1Cc1ccccc1)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1,C33721026_decoy,WEE1,Decoy,0.0,-8.64988,-8.04,-1.01,-7.270507916379494
CC(C)(C)C(=O)N1CCN(c2ccc(NC(=O)CSc3nnc(-c4ccc5ccccc5c4)o3)cc2)CC1,C33780517_decoy,WEE1,Decoy,0.0,-8.42612,-9.4,-2.06,-7.992541092722051
O=C(Nc1ccc(OC(F)(F)F)cc1)c1cc2nc(-c3ccc4c(c3)OCO4)cc(C(F)(F)F)n2n1,C59421778_decoy,WEE1,Decoy,0.0,-7.61714,-9.82,-2.32,-7.112682887945764
COc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccc(Cl)cc1Cl,C59425667_decoy,WEE1,Decoy,0.0,-8.79678,-7.86,-1.52,-6.663180656177047
COc1ccc(-c2csc(N3N=C(C)/C(=N/N=c4/[nH]c(-c5ccc(C)cc5)cs4)C3=O)n2)cc1,C59461748_decoy,WEE1,Decoy,0.0,-10.7341,-8.74,-2.74,-10.124081288867728
COC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])sc(C)c1-c1ccc(C(C)(C)C)cc1,C04199842_decoy,WEE1,Decoy,0.0,-8.39306,-5.29,-3.06,-7.117493647916998
CC(C)(C)[C@H]1CCc2c(sc3ncnc(SCC(=O)Nc4cccc(C(=O)[O-])c4)c23)C1,C06075285_decoy,WEE1,Decoy,0.0,-9.42545,-8.9,-1.27,-8.04440464892671
CC(C)OC(=O)c1c(-c2ccc(Br)cc2)csc1NC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)[O-],C08455815_decoy,WEE1,Decoy,0.0,-8.56631,-7.93,-2.03,-7.609548936189409
CCOC(=O)c1c(-c2cccc3ccccc23)csc1NC(=O)[C@@H]1CCCC[C@H]1C(=O)[O-],C08455891_decoy,WEE1,Decoy,0.0,-7.96487,-9.01,-2.72,-7.746539123507475
O=C([O-])/C=C/c1ccc(S(=O)(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)cc1,C13239794_decoy,WEE1,Decoy,0.0,-7.94675,-6.73,-2.22,-5.85495520832015
CCN(CC)c1ccc(C(F)(F)F)cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1Br,C13247930_decoy,WEE1,Decoy,0.0,-8.63642,-7.76,-3.04,-6.851375275572292
COc1cc(NS(=O)(=O)c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)c(Cl)cc1C(=O)[O-],C13267785_decoy,WEE1,Decoy,0.0,-9.51782,-7.91,-4.71,-6.6535331263993855
O=C(CSc1nnc(Cc2cccs2)n1C1CCCCC1)Nc1ccc(C(=O)[O-])cc1,C13355306_decoy,WEE1,Decoy,0.0,-9.57769,-9.35,-2.81,-7.890234738159295
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)/C=C/c3ccc(C(F)(F)F)cc3)cc2)cc1,C13362272_decoy,WEE1,Decoy,0.0,-7.99911,-10.78,-2.04,-7.844368607908635
CC[C@@H]1CCc2sc(-c3nnc(SCC(=O)Nc4ccc(C(=O)[O-])cc4)n3C)cc2C1,C13364638_decoy,WEE1,Decoy,0.0,-10.1089,-7.25,-1.39,-7.301502401794344
O=S(=O)([N-]c1nc2ccccc2nc1Nc1ccc(Br)cc1F)c1ccccc1,C17206049_decoy,WEE1,Decoy,0.0,-6.8689,-9.15,-1.49,-7.414578762266543
Cc1ccc(NC(=S)N2CCC(c3cc([O-])n4nc(-c5ccc(Cl)cc5)cc4n3)CC2)c(Cl)c1,C20213470_decoy,WEE1,Decoy,0.0,-9.98419,-3.86,-2.7,-4.881100932558162
Cc1cccc(C)c1NC(=S)N1CCC(c2cc([O-])n3nc(-c4ccc(Cl)cc4)cc3n2)CC1,C20213473_decoy,WEE1,Decoy,0.0,-9.3303,-8.33,-2.85,-10.03479562207335
O=C(Nc1nc2ccc(F)cc2s1)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1,C20569904_decoy,WEE1,Decoy,0.0,-8.62152,-10.11,-2.38,-8.574279270383915
C[C@@H](NC(=O)c1ccc2c([O-])nc3c(-c4cccc(C(F)(F)F)c4)nnn3c2c1)c1ccc(F)cc1,C21867849_decoy,WEE1,Decoy,0.0,-7.81053,-10.17,-2.07,-7.271281113991487
COc1ccc([C@H](C)NC(=O)c2ccc(Cl)c([N-]S(=O)(=O)c3ccc(F)cc3)c2)cc1F,C21938228_decoy,WEE1,Decoy,0.0,-9.44048,-7.99,-1.85,-8.515136207037354
C=CCn1c([S-])nnc1-c1sc(NC(=O)c2oc3c(ccc4ccccc43)c2C)nc1C,C22972597_decoy,WEE1,Decoy,0.0,-7.6972,-10.97,-1.55,-8.256027978962273
CCC1=C(C(=O)OC)[C@H](c2ccccc2F)N2C(/C=C(\[O-])NCCc3cccs3)=CSC2=N1,C34923108_decoy,WEE1,Decoy,0.0,-9.03435,-6.63,-3.32,-8.615801561246343
CCC1=C(C(=O)OC)[C@@H](c2cccc(F)c2)N2C(/C=C(\[O-])NC3CCCCC3)=CSC2=N1,C34923149_decoy,WEE1,Decoy,0.0,-8.4261,-9.22,-1.99,-8.319992557182793
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])Nc3cc(C)cc(C)c3)N2[C@H]1c1ccccc1OC,C34923748_decoy,WEE1,Decoy,0.0,-8.10879,-6.18,-2.03,-5.038974286502998
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC3CCCCC3)N2[C@H]1c1ccccc1F,C34923970_decoy,WEE1,Decoy,0.0,-6.65714,-4.78,-2.7,-3.3139432775016693
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccc3)N2[C@H]1c1ccccc1F,C34923980_decoy,WEE1,Decoy,0.0,-9.1825,-6.2,-1.29,-6.987197661023051
COc1cc(/C=C(/NC(=O)c2ccccc2)C(=O)[O-])ccc1OCc1ccccc1Br,C35668244_decoy,WEE1,Decoy,0.0,-7.69469,-9.71,-0.97,-7.697766219268474
C=C(C)COc1c(I)cc(/C=C(/NC(=O)c2ccccc2)C(=O)[O-])cc1OC,C35668297_decoy,WEE1,Decoy,0.0,-9.09082,-7.24,-2.31,-8.22198290105711
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1cccc(C)c1,C35692832_decoy,WEE1,Decoy,0.0,-9.28009,-7.39,-4.24,-10.223984030853677
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@H]1c1ccccc1Cl,C35692856_decoy,WEE1,Decoy,0.0,-8.33368,-4.66,-3.1,-4.780378058495228
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@@H]1c1ccccc1,C35692914_decoy,WEE1,Decoy,0.0,-9.84993,-4.49,-3.77,-6.287619604836533
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@@H]1c1ccccc1Cl,C35692994_decoy,WEE1,Decoy,0.0,-8.11243,-4.49,-3.49,-4.824904707362435
CCN/C([O-])=C/C1=CSC2=NC(C)=C(C(=O)OCC)[C@@H](c3ccc(C(F)(F)F)cc3)N12,C35693420_decoy,WEE1,Decoy,0.0,-5.59218,-4.55,-1.86,-3.2598233056119987
CC1=C(C(=O)OC(C)C)[C@@H](c2cccs2)N2C(/C=C(\[O-])NC[C@@H]3CCCO3)=CSC2=N1,C35702017_decoy,WEE1,Decoy,0.0,-9.65145,-4.68,-1.68,-5.523030189899528
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])Nc3cc(C)cc(C)c3)N2[C@@H]1c1ccsc1,C35970459_decoy,WEE1,Decoy,0.0,-9.05724,-5.72,-1.18,-6.157441426816149
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NCC3CC3)N2[C@H]1c1ccccc1C,C36050016_decoy,WEE1,Decoy,0.0,-7.95051,-4.65,-2.76,-4.09383207224017
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])N[C@H](C)CC)N2[C@@H]1c1ccc(C(F)(F)F)cc1,C36050191_decoy,WEE1,Decoy,0.0,-6.93013,-4.65,-3.66,-4.537480654948388
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])Nc3ccc(F)cc3)N2[C@H]1c1ccccc1C,C36050679_decoy,WEE1,Decoy,0.0,-5.6049,-8.02,-5.16,-5.4660035577428046
CCN(CC)C(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC3CC3)N2[C@@H]1c1ccc(C(F)(F)F)cc1,C36052599_decoy,WEE1,Decoy,0.0,-7.43516,-4.18,-1.64,-5.2617301547466
CCC1=C(C(=O)OC)[C@@H](c2ccccc2C)N2C(/C=C(\[O-])NC[C@H]3CCCO3)=CSC2=N1,C36052788_decoy,WEE1,Decoy,0.0,-8.68436,-8.5,-2.42,-9.627302025745305
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NC(C)C)N2[C@H]1c1ccc(C)cc1,C36063053_decoy,WEE1,Decoy,0.0,-6.31483,-4.62,-3.42,-4.11574518010255
Cc1ccc(S(=O)(=O)[N-]c2ccccc2F)cc1C(=O)Nc1ccc(OC(F)(F)F)cc1,C36329125_decoy,WEE1,Decoy,0.0,-8.41972,-6.46,-3.75,-5.825452437912658
CCCNc1nc2c(s1)c([O-])nc1c2sc2nc(C(F)(F)F)cc(-c3ccco3)c21,C36612846_decoy,WEE1,Decoy,0.0,-9.24516,-10.83,-1.0,-13.853461909194992
CCCOc1ccc(C(=O)C2=C([O-])C(=O)N(CCO)[C@@H]2c2ccc(C(C)(C)C)cc2)cc1C,C40091582_decoy,WEE1,Decoy,0.0,-8.63833,-8.0,-2.37,-9.357641161404382
COC(=O)c1ccc(NC(=O)c2ccc([N-]S(=O)(=O)c3ccc(C)cc3)c(Cl)c2)cc1,C44838634_decoy,WEE1,Decoy,0.0,-7.7168,-9.46,-1.54,-14.328952027074344
O=C(Cn1c([S-])nnc1-c1ccc(Cl)cc1)Nc1cccc(-c2nc3ccccc3s2)c1,C45840892_decoy,WEE1,Decoy,0.0,-10.7667,-10.11,-2.79,-9.562032317395277
CC(/C=C/c1ccccc1)=N\NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1,C48571855_decoy,WEE1,Decoy,0.0,-9.16567,-7.13,-1.94,-6.30012555147029
CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@H](c4ccccc4O)c4sc([S-])nc4S[C@@H]3C2=O)cc1,C40475512_decoy,WEE1,Decoy,0.0,-7.37254,-5.08,-1.31,-4.608602098245574
C[C@H]1CCCCCCCCCC/C1=N\[N-]C1=NC(=O)[C@@H](CC(=O)Nc2nc3c(s2)CCC3)S1,C22506424_decoy,WEE1,Decoy,0.0,-10.2408,-9.31,-0.74,-14.948071026930204
CSc1nc(Nc2ccc(S(=O)(=O)/N=C(/C)[O-])cc2)c2c3c(sc2n1)CCCC3,C12211601_decoy,WEE1,Decoy,0.0,-10.0577,-8.42,-1.67,-11.426618996452609
[O-]/C(Cc1ccccc1)=N\C1=NN2C(=NC(c3ccc(Cl)cc3)=C[C@@H]2c2ccc(F)cc2)N1,C02250010_decoy,WEE1,Decoy,0.0,-8.78948,-9.01,-1.28,-7.936645532580281
O=C([O-])c1ccc([NH+]2CCC(Cc3ccccc3)CC2)c([N-]S(=O)(=O)c2cc(F)ccc2F)c1,C33253838_decoy,WEE1,Decoy,0.0,-8.00778,-10.43,-1.55,-8.737938616039227
COc1ccc(C(=O)Nc2ccc(N3CCN(c4cccc(C)c4C)CC3)cc2C(=O)[O-])cc1,C64590223_decoy,WEE1,Decoy,0.0,-7.95995,-8.45,-2.43,-6.399989660993862
COc1ccc(OC)c([C@H]2C3=C([O-])CCCC3=NC(C)=C2C(=O)Nc2nc3ccccc3s2)c1,C13142603_decoy,WEE1,Decoy,0.0,-7.13615,-5.32,-3.72,-5.300521203917689
O=S(=O)(c1ccccc1)N(C[C@H](O)C[NH+](Cc1ccccc1)Cc1ccccc1)c1cccc2ccccc12,C01781247_decoy,WEE1,Decoy,0.0,-7.71628,-9.43,-3.16,-9.344254639430329
CCCC/N=c1\ccc2c(cc1O)[C@@H]([NH+](C)Cc1ccccc1O)CCc1cc(OC)c(OC)c(OC)c1-2,C09046530_decoy,WEE1,Decoy,0.0,-10.1948,-6.92,-3.52,-7.516697725007484
CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=S)NC(=O)C[NH2+]C1CCCCCC1,C09346028_decoy,WEE1,Decoy,0.0,-10.784,-7.68,-2.88,-8.752203938652956
COc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)OC[C@@H]4CCC[NH+]5CCCC[C@@H]45)cc3n2)cc1OC,C15276445_decoy,WEE1,Decoy,0.0,-8.08456,-8.95,-1.8,-7.183803648890236
COc1ccc(C)c2sc(N(CC[NH+](C)C)C(=O)c3ccc(S(=O)(=O)N4CCC[C@H](C)C4)cc3)nc12,C17026773_decoy,WEE1,Decoy,0.0,-8.59819,-8.45,-2.26,-9.380633955054982
COc1cccc(/[NH+]=c2\oc3c(C)ncc(COC(C)=O)c3cc2C(=O)Nc2ccc(OC)cc2OC)c1,C20617254_decoy,WEE1,Decoy,0.0,-9.93176,-9.09,-2.47,-10.44692681555641
COc1cccc([C@H](C[NH+]2CCN(C(=O)Nc3ccc(OC)cc3OC)CC2)OCc2ccc(C#N)cc2)c1,C23446803_decoy,WEE1,Decoy,0.0,-9.25343,-8.85,-3.37,-9.51377333250304
COc1ccc(C(=O)Oc2ccc(-c3[nH+]c4cc(C)ccn4c3NC(C)(C)CC(C)(C)C)cc2OC)cc1,C33628232_decoy,WEE1,Decoy,0.0,-9.12592,-9.15,-2.71,-8.171656737689794
COc1ccc(C[NH+]2CCC(N(c3ccc4c(c3)OCO4)S(=O)(=O)c3ccc(F)cc3)CC2)c(OC)c1,C34683850_decoy,WEE1,Decoy,0.0,-7.8702,-7.27,-3.15,-6.642276998986424
COc1ccc(CN(CCCCCCNc2cccc[nH+]2)C(=O)Nc2cccc(C(F)(F)F)c2)cc1OC,C34971878_decoy,WEE1,Decoy,0.0,-9.19056,-8.52,-5.06,-5.521589209588462
Cc1ccc(C[NH+](Cc2ccc(F)cc2)Cc2nc(C(=O)N3CCN(c4ccccc4C)CC3)cs2)cc1,C35147460_decoy,WEE1,Decoy,0.0,-9.2914,-8.3,-3.26,-8.160982680668369
Cc1ccsc1CN(Cc1ccc(F)cc1)C(=O)CN(CC[NH+]1CCCC1)C(=O)C[C@@H](C)CC(C)(C)C,C35383430_decoy,WEE1,Decoy,0.0,-9.9359,-7.1,-3.02,-8.80925037826119
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)c3cccc(F)c3)CC2)N(CC)C(=O)N[C@@H]1c1ccc(C)cc1C,C35646635_decoy,WEE1,Decoy,0.0,-7.71863,-4.91,-3.42,-5.3364273406768765
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(C)C(=O)N[C@@H]1c1ccc(OC)cc1OC,C35646798_decoy,WEE1,Decoy,0.0,-7.49951,-8.02,-2.65,-7.771333577741143
COc1cc(-c2[nH+]c3cc(C)ccn3c2NC(C)(C)CC(C)(C)C)ccc1OC(=O)C12CC3CC(CC(C3)C1)C2,C35703250_decoy,WEE1,Decoy,0.0,-9.3408,-9.44,-5.12,-5.663136842224322
COCC[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(Cl)cc1)C[C@H](O)COCc1ccco1,C35778135_decoy,WEE1,Decoy,0.0,-9.2304,-6.73,-2.33,-7.432187479916866
COCC[NH+](Cc1c(-c2ccccc2)nn(C)c1Oc1ccc(Cl)cc1)C[C@@H](O)COCc1ccco1,C35778138_decoy,WEE1,Decoy,0.0,-8.62303,-7.38,-3.02,-8.076053856218751
COc1cc(C[NH+]2CCC(N(c3ccc(OC)c(OC)c3)S(=O)(=O)c3ccccc3)CC2)cc(OC)c1,C35831005_decoy,WEE1,Decoy,0.0,-10.4182,-8.26,-2.98,-10.426279702982091
C=CC[NH+]1CCN(C(=O)c2coc(COc3ccc4c(c3)[C@@H](c3ccc(C)cc3)N(C(=O)CC)CC4)n2)CC1,C35863275_decoy,WEE1,Decoy,0.0,-9.8171,-8.42,-5.02,-7.715698053529833
CCOC(=O)C1=C(C[NH+]2CCCN(C(=O)NC(C)(C)C)CC2)N(C)C(=O)N[C@H]1c1cc(OC)cc(OC)c1,C36006700_decoy,WEE1,Decoy,0.0,-8.10769,-5.4,-3.08,-4.474339067519209
CCOC(=O)[C@H]1CCCN(C(=O)c2coc(C[NH+](Cc3ccc4c(c3)OCO4)Cc3cc(C)ccc3C)n2)C1,C36065902_decoy,WEE1,Decoy,0.0,-7.88437,-9.31,-2.97,-8.118934154017309
CCOC(=O)[C@@H]1CCCN(C(=O)c2coc(C[NH+](Cc3cc(OC)ccc3OC)[C@@H](C)c3ccccc3)n2)C1,C36073362_decoy,WEE1,Decoy,0.0,-8.31273,-8.09,-4.59,-8.77468798030241
CCOC(=O)[C@H]1CCCN(C(=O)c2coc(C[NH+](Cc3cc(OC)ccc3OC)[C@@H](C)c3ccccc3)n2)C1,C36073363_decoy,WEE1,Decoy,0.0,-8.56084,-8.09,-3.44,-8.093899879399244
CC(C)[NH+](CC(=O)N1CCc2sccc2[C@@H]1COc1ccc(F)cc1)C[C@@H](O)COCc1ccccc1,C36309751_decoy,WEE1,Decoy,0.0,-9.42804,-6.99,-3.61,-7.648549767978276
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)N(CC[NH+](C)C)c2nc3ccc(C)cc3s2)cc1,C36637282_decoy,WEE1,Decoy,0.0,-9.66563,-9.25,-2.55,-9.064511768281584
Cc1ccc2sc(N(CC[NH+](C)C)C(=O)c3ccc(S(=O)(=O)N(C)C4CCCCC4)cc3)nc2c1C,C36637599_decoy,WEE1,Decoy,0.0,-9.71614,-7.76,-1.08,-8.440186448024967
COc1cc(C[NH+]2CCC(N(c3ccc(C)cc3)S(=O)(=O)c3ccc(Cl)cc3)CC2)cc(OC)c1,C37560539_decoy,WEE1,Decoy,0.0,-8.19847,-8.45,-3.75,-7.171770946561594
C=CC[NH+]1CCN(C(=O)c2ccc(COc3ccc4c(c3)[C@@H](c3ccc(C)cc3)N(C(=O)CC)CC4)o2)CC1,C34685758_decoy,WEE1,Decoy,0.0,-9.67937,-9.95,-1.98,-12.447927495200371
CCCN(CCC)S(=O)(=O)c1ccc(C(=O)N(CCC[NH+](C)C)c2nc3ccc(F)cc3s2)cc1,C36643278_decoy,WEE1,Decoy,0.0,-9.10046,-7.95,-2.01,-10.614064436103796
Cc1cc(C)c2sc(N(CCC[NH+](C)C)C(=O)c3ccc(S(=O)(=O)N4CCCC[C@H]4C)cc3)nc2c1,C36643740_decoy,WEE1,Decoy,0.0,-10.7688,-9.9,-2.05,-10.90541505102938
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N(CCC[NH+](C)C)c2nc3ccc(Cl)cc3s2)cc1,C36660279_decoy,WEE1,Decoy,0.0,-8.34898,-8.4,-2.8,-8.114099694507685
CC[NH+](CC)CCN(C(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1)c1nc2ccc(F)cc2s1,C36660280_decoy,WEE1,Decoy,0.0,-8.9542,-4.72,-4.5,-5.51637798395865
CCc1ccc2nc(N(CC[NH+](CC)CC)C(=O)[C@H]3CCCN3S(=O)(=O)c3ccc(F)cc3)sc2c1,C36660339_decoy,WEE1,Decoy,0.0,-9.99389,-9.09,-3.51,-10.892489518309276
CCc1ccc2nc(N(CCC[NH+](C)C)C(=O)[C@H]3CCCN3S(=O)(=O)c3ccc(F)cc3)sc2c1,C36660341_decoy,WEE1,Decoy,0.0,-9.07093,-9.31,-4.35,-7.877262965049334
C[NH+](C)CCCN(C(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)cc1)c1nc2ccc(Cl)cc2s1,C36660347_decoy,WEE1,Decoy,0.0,-9.65644,-5.7,-3.79,-6.481705850499615
Cc1cc2nc(N(CCC[NH+](C)C)C(=O)c3ccc(S(=O)(=O)N4CCCCC4)cc3)sc2cc1C,C36698942_decoy,WEE1,Decoy,0.0,-10.2833,-9.64,-1.9,-12.013405454055231
Cc1cc2nc(N(CCC[NH+](C)C)C(=O)c3ccc(S(=O)(=O)N4CCCC[C@H]4C)cc3)sc2cc1C,C36698966_decoy,WEE1,Decoy,0.0,-9.74525,-9.76,-2.39,-11.701063168781047
Cc1cc(C)c2nc(N(CCC[NH+](C)C)C(=O)C3CCN(S(=O)(=O)c4cccs4)CC3)sc2c1,C36704291_decoy,WEE1,Decoy,0.0,-12.1565,-9.18,-1.96,-13.74602208797563
COc1ccc2nc(N(CCC[NH+](C)C)C(=O)C3CCN(S(=O)(=O)c4ccc(C)cc4)CC3)sc2c1,C38847398_decoy,WEE1,Decoy,0.0,-8.77871,-8.71,-2.63,-6.806339495179754
COc1ccc(C(C)C)cc1C[NH+]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(N3CCCC3)cc2)CC1,C39303729_decoy,WEE1,Decoy,0.0,-10.2374,19.2,-3.45,3.6567545212291694
C[NH+]1CCN(Cc2cc(-c3ccc(F)cc3)ccc2OCC(=O)NCc2ccc(C(F)(F)F)cc2)CC1,C23362331_decoy,WEE1,Decoy,0.0,-8.19333,-9.81,-2.56,-7.643813282491109
Cc1ccc(C)c2sc(N(CCC[NH+](C)C)C(=O)[C@@H]3CCCCN3S(=O)(=O)c3cccs3)nc12,C36648091_decoy,WEE1,Decoy,0.0,-9.23547,-4.17,-2.04,-5.803897581748346
COC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)CN1CC[NH+](Cc2ccc(SC)cc2)CC1,C39972179_decoy,WEE1,Decoy,0.0,-9.90326,-8.09,-2.41,-7.609505122570044
CCCCc1nn2c(=O)cc(N3CCN(c4ccc([N+](=O)[O-])c(NCc5ccccc5)c4)CC3)[nH+]c2s1,C05946680_decoy,WEE1,Decoy,0.0,-9.26658,-8.24,-2.18,-7.832213298265782
COc1ccc(CCN(C(=S)Nc2cc(C(F)(F)F)ccc2Cl)C2CC[NH+](C)CC2)cc1OC,C59081001_decoy,WEE1,Decoy,0.0,-8.80669,-9.09,-2.54,-9.635395935613678
CCN(CC)c1ccc2cc(C(=O)Nc3ccc(C)cc3)/c(=[NH+]/NS(=O)(=O)c3ccc(C)cc3)oc2c1,C59170417_decoy,WEE1,Decoy,0.0,-10.2917,-9.48,-4.06,-8.843331351660945
COc1ccc([C@H]2NCCC3=c4cc(OCc5ccccc5)ccc4=[NH+][C@H]32)cc1COc1c(C)cccc1C,C63349897_decoy,WEE1,Decoy,0.0,-9.6557,-6.92,-3.35,-6.20598862842902
Cc1ccc2c(c1)S[C@H](c1ccc(NC(=O)[C@@H](CC3=c4ccccc4=[NH+]C3)NC(=O)OCC(C)C)cc1)N2,C63503229_decoy,WEE1,Decoy,0.0,-8.86293,-7.54,-3.21,-7.08897260278061
COc1ccc([C@H]2NCCC3=c4cc(OCc5ccccc5)ccc4=[NH+][C@@H]32)cc1COc1cccc(C)c1C,C63581925_decoy,WEE1,Decoy,0.0,-9.58413,-9.86,-3.29,-7.0214075663239806
COc1ccc(NC(=O)[C@@H](c2ccc(OC)cc2)N(Cc2ccco2)C(=O)CC2=c3ccccc3=[NH+]C2)cc1,C63617069_decoy,WEE1,Decoy,0.0,-8.94297,-8.29,-3.06,-9.070259263467186
O=P(OCc1ccccc1)(OCc1ccccc1)OP(=O)(OCc1ccccc1)OCc1ccccc1,C04352564_decoy,WEE1,Decoy,0.0,-6.66926,-9.28,-4.2,-13.278335791655852
COc1ccc(-n2c(SCC(=O)Nc3cccc(C)c3)nnc2-c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)cc1,C00906896_decoy,WEE1,Decoy,0.0,-11.0516,-10.27,-2.41,-9.888768756629204
CC(=O)c1cc(CN(N(C)c2ncc(C(F)(F)F)cc2Cl)S(=O)(=O)c2ccc3ccccc3c2)on1,C01389174_decoy,WEE1,Decoy,0.0,-7.73891,-9.11,-4.67,-8.128877134803082
CCOC(=O)c1nn(-c2ccc(C)cc2)c(C)c1C(=O)c1noc(-c2ccc(C)cc2)c1S(=O)(=O)c1ccccc1,C04292481_decoy,WEE1,Decoy,0.0,-8.21076,-8.1,-3.72,-9.973587091370211
COc1ccc(-c2nnn(CC(=O)N(Cc3cccs3)[C@@H](C(=O)NC3CCCCC3)c3ccco3)n2)cc1,C00888344_decoy,WEE1,Decoy,0.0,-8.41031,-9.54,-3.77,-8.937757253013642
CC(C)N1C(=O)C(C(=O)C(C)(C)C)=C(C(C)(C)C)OC12OC(C(C)(C)C)=C(C(=O)C(C)(C)C)C(=O)N2C(C)C,C02077754_decoy,WEE1,Decoy,0.0,-6.73647,-3.63,-3.71,-4.434288567150823
COc1ccc(NC(=O)[C@H]([C@H]2CC=CCC2)N(Cc2nc(-c3ccccc3)cs2)C(=O)CSc2nc(C)cc(C)n2)cc1,C08712472_decoy,WEE1,Decoy,0.0,-9.41217,-8.57,-3.21,-8.906528952210095
C=CCn1c(SCC(=O)Nc2cccc(C)c2)nnc1-c1ccc(NC(=O)c2csc3c2CCCC3)cc1,C03764216_decoy,WEE1,Decoy,0.0,-9.06284,-8.84,-2.67,-7.298455969778343
C=CCn1c(SCC(=O)Nc2ccc(OC)cc2)nnc1-c1ccc(NC(=O)c2csc3c2CCCC3)cc1,C03764235_decoy,WEE1,Decoy,0.0,-11.2032,-8.75,-2.97,-8.148011602783537
C=CCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1-c1ccc(NC(=O)c2csc3c2CCCC3)cc1,C03764221_decoy,WEE1,Decoy,0.0,-11.629,-8.54,-3.57,-8.204887247339236
CCOc1cccc2s/c(=N\C(=O)c3ccc(S(=O)(=O)N4C[C@@H](C)C[C@H](C)C4)cc3)n(CCOC)c12,C08958596_decoy,WEE1,Decoy,0.0,-8.61149,-7.7,-1.55,-6.972712414851531
COC(=O)c1ccc(NC(=O)c2cnn(-c3ccc(C)cc3C)c2C2CCN(C(=O)OC(C)(C)C)CC2)cc1,C09264916_decoy,WEE1,Decoy,0.0,-9.50611,-8.41,-3.92,-7.845913043595239
COC(=O)c1cc(OCc2cn(-c3ccc(C(F)(F)F)cc3)nn2)cc(OCc2cn(-c3ccc(C(F)(F)F)cc3)nn2)c1,C12951079_decoy,WEE1,Decoy,0.0,-8.59918,-7.95,-2.9,-7.228584788608726
CCOCCn1/c(=N/C(=O)c2ccc(S(=O)(=O)N(C)C[C@H]3CCCO3)cc2)sc2c(C)ccc(C)c21,C12063477_decoy,WEE1,Decoy,0.0,-8.52108,-8.35,-3.21,-9.3494390498596
C=C/C(C)=C/C[C@]1(C)[C@H]2C[C@H](OC(=O)CCCCC)C=C3[C@H](OC(C)=O)O[C@H](OC(C)=O)[C@@]32[C@H](O)C[C@@H]1C,C15155873_decoy,WEE1,Decoy,0.0,-8.65887,-4.12,-4.07,-3.947259198926864
CC[C@H](C)N(CC(=O)N1CCc2sccc2[C@H]1c1ccc(C(C)(C)C)cc1)C(=O)c1ccc([N+](=O)[O-])cc1,C16503460_decoy,WEE1,Decoy,0.0,-9.74044,-9.91,-4.77,-9.396179582822764
CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2ccc([N+](=O)[O-])cc2)C2=C(C[C@H](c3ccc(N(C)C)cc3)CC2=O)N1,C20418921_decoy,WEE1,Decoy,0.0,-8.03763,-4.93,-3.72,-4.530540041925262
CCOC(=O)N1CCN(Cc2ccc(OC[C@H]3CCCN(C(=O)c4ccc(C(F)(F)F)cc4)C3)cc2)CC1,C20600501_decoy,WEE1,Decoy,0.0,-9.17473,-8.58,-2.95,-6.961878185531426
CCOc1ccc(S(=O)(=O)N(CC(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c2ccccc2)cc1,C22346562_decoy,WEE1,Decoy,0.0,-8.9692,-8.31,-3.36,-7.504844776818796
CCCC12CN(C(=O)c3ccc(OC(C)C)cc3)CC(CC)(CN(C(=O)c3ccc(OC(C)C)cc3)C1)C2=O,C27517155_decoy,WEE1,Decoy,0.0,-7.92496,-3.67,-3.35,-4.715617156385466
CC(C)OC(=O)c1c(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](c2ccc([N+](=O)[O-])cc2)N3)sc2c1CCCC2,C01811156_decoy,WEE1,Decoy,0.0,-8.88098,-10.15,-2.22,-7.74638482102253
COc1ccc(CCN(Cc2sccc2C)C(=O)CN(CC(C)C)C(=O)Nc2ccccc2C)cc1OC,C33400458_decoy,WEE1,Decoy,0.0,-8.67697,-6.65,-2.74,-6.389491038049857
COc1cc(NC(=O)N(CCC(C)C)CC(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(C)c2)cc(OC)c1,C33688976_decoy,WEE1,Decoy,0.0,-8.86215,-9.1,-3.68,-8.64372991674531
COc1ccc(CCN(Cc2cccs2)C(=O)CN(C(=O)Nc2ccc(C(C)C)cc2)C2CC2)cc1OC,C33731893_decoy,WEE1,Decoy,0.0,-9.10984,-8.48,-2.69,-7.940416767174681
CCOC(=O)C1=C(C)NC2=C(C(=O)[C@H](C(=O)OCC)[C@H](c3ccc(OC)cc3)C2)[C@@H]1c1ccc(N(C)C)cc1,C09993414_decoy,WEE1,Decoy,0.0,-8.82334,-4.23,-4.29,-5.597953025310587
C=CCN1C(=O)N[C@@H](c2ccccc2C(F)(F)F)C2=C1CN([C@@H](CC(C)C)C(=O)N1CCC(C)CC1)C2=O,C34791550_decoy,WEE1,Decoy,0.0,-7.96009,-8.61,-4.14,-10.181606797802022
CCOC(=O)C1=C(CN2CCN(C(=O)c3ccc(C)cc3)[C@H](C)C2)N(CC)C(=O)N[C@@H]1c1ccc(OC)cc1,C35646529_decoy,WEE1,Decoy,0.0,-9.13382,-5.78,-3.78,-6.404885324568336
CCCNC(=O)N1CCN(CC2=C(C(=O)OCC)[C@H](c3cc(OC)cc(OC)c3)NC(=O)N2CC)C[C@@H]1C,C36017138_decoy,WEE1,Decoy,0.0,-8.93936,-5.98,-4.07,-5.145384154132202
CCCCCCN(C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)[C@H](C(=O)NC(C)(C)C)c1ccccc1C,C36507945_decoy,WEE1,Decoy,0.0,-8.76976,-7.94,-3.73,-8.068797468786975
CCCCCCN(C(=O)[C@@H](OC)c1ccccc1)[C@@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc2c(c1)OCO2,C36509082_decoy,WEE1,Decoy,0.0,-8.32068,-5.75,-3.79,-7.176973759516092
CCCCNC(=O)[C@@H](c1ccc(OC)c(OC)c1)N(CCC)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1,C36560067_decoy,WEE1,Decoy,0.0,-8.09245,-4.16,-2.46,-5.392332487209969
CC(C)(C)NC(=O)[C@@H](c1ccc2c(c1)OCO2)N(C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)C(C)(C)C,C36579606_decoy,WEE1,Decoy,0.0,-7.49788,-9.08,-3.89,-9.026722814256711
CSN1CCC(CN2C(=O)N(S(=O)(=O)C(C)C)C[C@@]2(C)S(=O)(=O)C(C)C)(C2CCCCC2)CC1,C39490907_decoy,WEE1,Decoy,0.0,-9.0265,-4.69,-4.15,-3.656458266714565
CCCCN(CCCC)S(=O)(=O)c1ccc(C(=O)/N=c2\sc3cc(C)c(C)cc3n2CCOC)cc1,C36698263_decoy,WEE1,Decoy,0.0,-8.82127,-6.51,-3.89,-8.607158755692897
COc1ccc(-c2nc(-c3ccc(N4CCC[C@@H](C(=O)NCCC5=CCCCC5)C4)c(F)c3)no2)cc1OC,C40899612_decoy,WEE1,Decoy,0.0,-10.7822,-9.86,-3.7,-8.751196352670483
CC(C)(C)c1ccc(C(=O)c2cccc(NC(=O)c3cccc(CN4CCN(S(C)(=O)=O)CC4)c3)c2)cc1,C44938923_decoy,WEE1,Decoy,0.0,-10.7629,-9.96,-2.83,-8.620751198177272
Cc1ccc(-c2nnn(CC(=O)N(CCc3ccccc3C)[C@@H](C(=O)NC3CCCC3)c3ccncc3)n2)cc1,C00887337_decoy,WEE1,Decoy,0.0,-8.28045,-8.45,-3.77,-7.760839440189662
CN(C)c1ccc([C@@H](C(=O)NC2CCCC2)N(C(=O)Cn2nnc(-c3cccs3)n2)c2cccc3ccccc23)cc1,C00887379_decoy,WEE1,Decoy,0.0,-10.2361,-7.3,-2.73,-7.452016146183204
O=C(NC[C@H]1CCCO1)[C@H](c1ccc(F)cc1)N(C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)c1ccc(Cl)cc1,C00903771_decoy,WEE1,Decoy,0.0,-7.62234,-6.19,-1.57,-5.09814549080909
COc1cc([C@@H](C(=O)NC2CCCCC2)N(C(=O)Cc2cccs2)c2ccc(C)c(C)c2)cc(OC)c1OC,C00921896_decoy,WEE1,Decoy,0.0,-9.96307,-7.77,-5.45,-8.412538829324877
COc1ccc([C@@H](C(=O)NC2CCCCC2)N(C(=O)Cc2cccs2)c2ccc3c(c2)OCCO3)cc1OC,C00921953_decoy,WEE1,Decoy,0.0,-9.85417,-6.2,-3.37,-7.072983750914505
COc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)Cc2cccs2)c2ccc3c(c2)OCCO3)cc1OC,C00921954_decoy,WEE1,Decoy,0.0,-8.63632,-8.07,-4.6,-9.311388744908216
COc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)Cc2cccs2)c2ccc3c(c2)OCO3)cc1OC,C00921957_decoy,WEE1,Decoy,0.0,-10.1586,-7.25,-4.74,-8.787530704647905
CCOc1cc(/C=N/NC(=O)CSc2nc3sc4c(c3c(=O)n2-c2ccc(C)cc2)CCCC4)ccc1O,C01762768_decoy,WEE1,Decoy,0.0,-10.8012,-9.07,-3.34,-7.942641610347912
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(-c4ccc(C(=O)OC)cc4)o3)c(=O)n2[C@@H]1c1ccc(F)cc1,C01803656_decoy,WEE1,Decoy,0.0,-7.79515,-8.25,-2.01,-5.849498653552011
COCCOC(=O)C1=C(C)N=c2s/c(=C\c3ccccc3OC)c(=O)n2[C@@H]1c1ccc(OC(=O)c2ccco2)cc1,C01830025_decoy,WEE1,Decoy,0.0,-9.50367,-8.88,-2.65,-8.55683066291162
CCOC(=O)C1=C[C@@]2(SC=C(C(=O)OCC)S2)C2=C(S1)C(C)(C)N(C(=O)CC(C)C)c1ccc(OCC)cc12,C01886585_decoy,WEE1,Decoy,0.0,-8.14171,-5.69,-3.99,-6.3940192379879495
COc1ccc(/C=N/OCc2nc3c4c(ncn3n2)OC2=C(C(=O)CC(C)(C)C2)[C@H]4c2ccc(OC)c(OC)c2)cc1,C01897584_decoy,WEE1,Decoy,0.0,-8.58555,-6.38,-1.51,-5.308382673140621
COc1cc(CN2C(=O)[C@](NC(=O)c3cccc(C(F)(F)F)c3)(C(F)(F)F)C3=C2CC(C)(C)CC3=O)cc(OC)c1,C01899098_decoy,WEE1,Decoy,0.0,-8.27995,-5.34,-2.48,-5.657807863547846
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1nnc(COc2ccc(OC)cc2)n1-c1ccccc1F,C03294601_decoy,WEE1,Decoy,0.0,-8.54017,-7.89,-3.33,-7.492753695113341
CSc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2C(=O)[O-])c2ccc(C)cc2)cc1,C02978395_decoy,WEE1,Decoy,0.0,-8.16127,-8.31,-2.02,-8.664436746875662
O=C(CSc1nnc(-c2ccco2)n1-c1cccc2ccccc12)Nc1ccc(C(=O)[O-])cc1,C09233156_decoy,WEE1,Decoy,0.0,-9.53943,-7.7,-3.35,-7.694057898196515
CCOC(=O)c1c(-c2ccc(C)cc2C)csc1NC(=O)CSc1nc(C)cc(C)c1C(=O)[O-],C13022521_decoy,WEE1,Decoy,0.0,-8.80353,-8.78,-2.74,-7.243968718917156
CCOC(=O)C1=C(C)N(c2ccc(C(=O)[O-])cc2)C(=O)N[C@H]1c1cc(Br)cs1,C13033126_decoy,WEE1,Decoy,0.0,-8.70041,-4.4,-2.42,-4.8847000732281
CCOC(=O)C1=C(C)N(c2ccc(C(=O)[O-])cc2)C(=O)N[C@@H]1c1ccc(Br)s1,C13033128_decoy,WEE1,Decoy,0.0,-8.07621,-4.96,-1.64,-4.368127899757636
CCOC(=O)C1=C(C)N(c2ccc(C(=O)[O-])cc2)C(=O)N[C@@H]1c1ccc(OC)c(Br)c1,C13060272_decoy,WEE1,Decoy,0.0,-7.96598,-8.92,-1.74,-14.904092843081324
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)/C=C/c3cc(Cl)c4c(c3)OCO4)cc2)cc1,C13078284_decoy,WEE1,Decoy,0.0,-10.3451,-10.6,-4.27,-8.595663576517122
COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)Nc1cc(Cl)ccc1C(=O)[O-],C13186035_decoy,WEE1,Decoy,0.0,-8.95175,-8.39,-1.74,-10.320647148604465
COc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)[O-])cc1S(=O)(=O)N1C[C@H](C)C[C@H](C)C1,C13187553_decoy,WEE1,Decoy,0.0,-9.21193,-9.36,-2.29,-9.86636157931421
Cc1ccc(-c2nnc(SCC(=O)N[C@@H](c3ccc(F)cc3)c3cccs3)n2CC(=O)[O-])cc1,C13220668_decoy,WEE1,Decoy,0.0,-10.3447,-8.51,-3.21,-8.431906881599653
Cc1ccc(-n2c(SCC(=O)Nc3cc(Cl)ccc3C(=O)[O-])nnc2N2CCCC2)cc1,C13223378_decoy,WEE1,Decoy,0.0,-9.44232,-8.85,-1.75,-9.264859487438017
Cc1cccc(C(=O)[O-])c1NC(=O)CSc1nnc(Cc2cccs2)n1CCc1ccccc1,C13241638_decoy,WEE1,Decoy,0.0,-9.92431,-8.09,-3.9,-8.71782489073534
Cc1ccc(-n2c(SCC(=O)Nc3ccc(Cl)cc3C(=O)[O-])nnc2N2CCCC2)cc1,C13245588_decoy,WEE1,Decoy,0.0,-9.25766,-8.71,-1.4,-11.258832074877876
CC[C@@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1,C13250946_decoy,WEE1,Decoy,0.0,-7.97699,-9.17,-3.81,-8.716576992962443
CC[C@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1,C13250948_decoy,WEE1,Decoy,0.0,-7.24973,-8.84,-3.25,-8.85755105785493
COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)Nc1ccc(Cl)cc1C(=O)[O-],C13260177_decoy,WEE1,Decoy,0.0,-8.0149,-9.16,-3.34,-7.408054575660585
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)/C=C/c3ccccc3OC(F)(F)F)cc2)cc1,C13272892_decoy,WEE1,Decoy,0.0,-8.41686,-6.5,-5.74,-5.853281519337709
COc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1cccc(C(=O)[O-])c1,C13309697_decoy,WEE1,Decoy,0.0,-8.1403,-9.49,-2.76,-8.687561829951079
COC(=O)c1ccc([C@@H]2c3c(-c4ccc(C)cc4)n[nH]c3C(=O)N2c2ccc(C(=O)[O-])cc2)cc1,C09679120_decoy,WEE1,Decoy,0.0,-9.13906,-4.87,-1.89,-5.4927446693873625
CCOC(=O)c1c(NC(=O)CSc2nc(C)c(Cc3ccccc3)c([O-])n2)sc2c1CCCC2,C32522632_decoy,WEE1,Decoy,0.0,-9.76746,-8.64,-2.44,-8.115503608702237
COc1ccc(N2CCN(c3ccc(C(=O)[O-])cc3NS(=O)(=O)c3ccccc3C)CC2)cc1,C32961942_decoy,WEE1,Decoy,0.0,-8.97439,-5.77,-2.57,-5.2347052054054855
Cc1ccc(S(=O)(=O)Nc2ccc(N3CCN(c4ccc(F)cc4)CC3)c(C(=O)[O-])c2)cc1,C33253049_decoy,WEE1,Decoy,0.0,-9.18231,-9.59,-4.47,-8.419843733138848
CCC(=O)Nc1c(C)noc1/C=C/c1ccc(S(=O)(=O)[N-]c2cccc(Br)c2)s1,C33306582_decoy,WEE1,Decoy,0.0,-9.43912,-9.77,-2.04,-12.592880605821474
COc1ccc([C@H]2CC(=O)Nc3nc(SCc4ccccc4C)nc([O-])c32)c(OC)c1OC,C13567356_decoy,WEE1,Decoy,0.0,-7.43103,-6.66,-2.98,-6.37888107027121
CCC1=C(C(=O)OC)[C@@H](c2cccc(OC)c2)N2C(/C=C(\[O-])NCc3ccccc3F)=CSC2=N1,C34923239_decoy,WEE1,Decoy,0.0,-9.42328,-5.3,-2.77,-6.076260767095919
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1[C@@H](C(=O)[O-])[C@@H](c2ccccc2)C=C[C@@H]1c1ccccc1,C35023493_decoy,WEE1,Decoy,0.0,-7.21367,-8.68,-1.84,-8.526425948460556
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NCCOC)N2[C@@H]1c1cccs1,C35692882_decoy,WEE1,Decoy,0.0,-7.38671,-5.12,-2.28,-4.4130864400566185
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccc(F)cc3)N2[C@H]1c1cccs1,C35695879_decoy,WEE1,Decoy,0.0,-8.56271,-5.15,-2.5,-6.337397381667329
CCOC(=O)C1=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1ccccc1C,C35703556_decoy,WEE1,Decoy,0.0,-8.14337,-4.93,-1.95,-4.9548178846988655
CC1=C(C(=O)OC(C)C)[C@@H](c2cccc(C)c2)N2C(/C=C(\[O-])NC[C@@H]3CCCO3)=CSC2=N1,C35704651_decoy,WEE1,Decoy,0.0,-7.78779,-5.17,-1.12,-5.999697713232509
COCCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])Nc3ccc(F)cc3)N2[C@H]1c1ccc(F)cc1,C36050111_decoy,WEE1,Decoy,0.0,-7.47961,-6.87,-5.19,-4.969918014449569
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1cccc(C)c1,C36053143_decoy,WEE1,Decoy,0.0,-9.0532,-7.97,-2.92,-8.13407464079783
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1ccc(C(C)C)cc1,C36053523_decoy,WEE1,Decoy,0.0,-9.44878,-8.76,-1.64,-8.66282960773131
CCOC(=O)C1=C(c2ccccc2)N=C2SC=C(/C=C(\[O-])NCCOC)N2[C@H]1c1ccc(Cl)cc1,C36063103_decoy,WEE1,Decoy,0.0,-7.18086,-6.83,-3.26,-5.98748404453883
CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2F)N2C(/C=C(\[O-])NCc3ccco3)=CSC2=N1,C36064999_decoy,WEE1,Decoy,0.0,-8.56282,-4.71,-1.16,-5.406671142142772
COc1ccccc1[C@@H]1C(C(=O)OC(C)C)=C(C(F)(F)F)N=C2SC=C(/C=C(\[O-])NCC3CC3)N21,C36065056_decoy,WEE1,Decoy,0.0,-7.86087,-4.42,-1.2,-4.588302839053271
CC1=C(C(=O)OC(C)C)[C@@H](c2ccc(C)cc2C)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C36071907_decoy,WEE1,Decoy,0.0,-9.22557,-5.33,-3.43,-5.871550241670043
Cc1cc(O[C@H](C)C(=O)NCC2CCC(C(=O)[O-])CC2)c2c(C)c(Cc3ccccc3)c(=O)oc2c1,C02116562_decoy,WEE1,Decoy,0.0,-7.77283,-9.53,-2.75,-10.250532202355878
O=C(Cn1c([S-])nnc1-c1ccc(Cl)cc1)NCc1ccc(-c2nc3ccccc3s2)o1,C32722323_decoy,WEE1,Decoy,0.0,-9.92452,-5.94,-5.18,-5.723650533816151
COc1ccc(C(=O)[O-])cc1S(=O)(=O)/N=c1/[nH]c(-c2ccc(OC(F)F)cc2)c(C)s1,C13030714_decoy,WEE1,Decoy,0.0,-8.7047,-8.02,-1.47,-8.226485732100425
COc1cc([C@@H]2NC(=O)C([O-])=C2C(=O)c2ccc(OCc3ccc(C)cc3)cc2)ccc1OCC(C)C,C40127576_decoy,WEE1,Decoy,0.0,-10.3191,-9.77,-2.04,-10.521875497444908
CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2F)N2C(/C=C(\[O-])NC[C@H]3CCCO3)=CSC2=N1,C40401149_decoy,WEE1,Decoy,0.0,-8.79956,-4.52,-0.94,-4.902543899667951
Cc1cc(C)nc(SCC(=O)Nc2cccc(S(=O)(=O)[N-]c3cccc(C(F)(F)F)c3)c2)n1,C45292978_decoy,WEE1,Decoy,0.0,-8.47044,-10.01,-4.73,-7.727763801477292
CCCCn1c(SCc2nc3sc(C(=O)[O-])c(C)c3c(=O)[nH]2)nc2sc(C)c(C)c2c1=O,C13254624_decoy,WEE1,Decoy,0.0,-9.57262,-7.43,-1.68,-9.33234904123348
CCCn1c(SCc2cc(=O)[nH]c3sc(C(=O)[O-])c(C)c23)nc2sc3c(c2c1=O)CCC3,C13415967_decoy,WEE1,Decoy,0.0,-9.15721,-8.99,-1.74,-8.12416936062688
Cc1c(C(=O)[O-])sc2[nH]c(=O)cc(CSc3nnc(-c4ccco4)n3-c3ccc(F)cc3)c12,C13407643_decoy,WEE1,Decoy,0.0,-8.26081,-9.36,-2.38,-7.582673661636075
CC(C)[C@@H](Sc1nnc(-c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)n1C)C(=O)[O-],C59857083_decoy,WEE1,Decoy,0.0,-8.87824,-8.45,-2.46,-7.214077185021085
COc1cccc(NC(=O)C[C@@H]2SC([N-]/N=C3\CCCCCCCCCC[C@@H]3C)=NC2=O)c1,C22506141_decoy,WEE1,Decoy,0.0,-9.12176,-8.82,-3.79,-9.02126410513641
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc(Cl)s2)ccc1N1CCC([NH+]2CCCCC2)CC1,C32962147_decoy,WEE1,Decoy,0.0,-9.84109,-8.22,-2.44,-8.432332346985527
COc1ccc([C@H]2CC3=NC(=O)C[C@H](C(=O)Nc4ccc(Oc5ccccc5)cc4)C3=C([O-])C2)cc1,C10075313_decoy,WEE1,Decoy,0.0,-8.76121,-7.76,-1.29,-6.089631737712235
CCOc1cc(C)c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1C(C)C,C00818633_decoy,WEE1,Decoy,0.0,-7.23738,-4.29,-2.2,-4.56699456080989
Cc1cccc(C)c1NC(=O)N[C@@]1(C(F)(F)F)Oc2ccc(Cl)cc2O1,C02725359_decoy,WEE1,Decoy,0.0,-8.02514,-5.17,-1.65,-4.331474657629268
N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@H]1c1ccccc1,C00836099_decoy,WEE1,Decoy,0.0,-7.28327,-5.62,-0.47,-4.50355771963168
O=C(NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCCN1C(=O)NCc1ccccc1,C04891911_decoy,WEE1,Decoy,0.0,-7.45051,-6.2,-3.19,-5.611825499056419
C/C(=N/NC(=O)c1cc(-c2ccc(C)cc2)n[nH]1)c1ccc(Br)cc1,C05595813_decoy,WEE1,Decoy,0.0,-9.52625,-8.12,-1.13,-7.480929366630443
N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccc(-c3ccccc3)o1)Sc1ccccc12,C02242485_decoy,WEE1,Decoy,0.0,-8.60216,-6.1,-0.53,-5.008476092403104
CC1CCC(Nc2c(-c3ccc(Br)cc3)[nH]c3c(C#N)cnn23)CC1,C06768560_decoy,WEE1,Decoy,0.0,-8.30259,-8.82,-1.64,-9.340371229039736
CNC(=O)c1c(NC(=O)c2oc3cc(C)c(C)cc3c2C)sc2c1CCCC2,C06826276_decoy,WEE1,Decoy,0.0,-8.34817,-10.35,-1.54,-9.073964603489108
CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(Br)cc1)C1=C(CCCC1=O)N2,C00959844_decoy,WEE1,Decoy,0.0,-7.84183,-4.79,-1.91,-4.304801728194815
CC1(C)CC(=O)C2=C(C1)Nc1ccc3ncccc3c1[C@H]2c1c[nH]nc1-c1ccc(F)cc1,C00718235_decoy,WEE1,Decoy,0.0,-7.95804,-5.9,-1.99,-4.6584067848281
C/C(=N/NC(=O)c1ccncc1)[C@@H]1CC[C@@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C,C12655693_decoy,WEE1,Decoy,0.0,-8.37495,-8.47,-1.47,-6.422005349847373
CC[C@H]1CCCCN1C(=O)CSc1nc(N)c2c3c(sc2n1)CCCC3,C06108909_decoy,WEE1,Decoy,0.0,-9.25051,-8.76,-1.67,-7.943127784332375
CSc1nc2nc(C(C)C)c(-c3ccc(Br)cc3)c(N)n2n1,C13638161_decoy,WEE1,Decoy,0.0,-7.85774,-8.71,-0.76,-7.377691905408692
Cc1sc2nc(COC(=O)c3cc4c(s3)CCCCC4)nc(N)c2c1C,C14075162_decoy,WEE1,Decoy,0.0,-9.54866,-9.34,-0.97,-8.679328573056019
Cc1c([N+](=O)[O-])ccc2c1N[C@H](c1cc(Cl)cc(Cl)c1O)[C@H]1CC=C[C@H]21,C14467121_decoy,WEE1,Decoy,0.0,-8.86171,-5.7,-1.41,-5.329542191949818
O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccccc1O)N2)N1CCCCC1,C14474001_decoy,WEE1,Decoy,0.0,-9.9517,-9.62,-3.53,-8.386320361357182
O=C1Nc2cc(Br)cnc2N/C1=C\C(=O)c1ccc(C2CCCCC2)cc1,C16401260_decoy,WEE1,Decoy,0.0,-9.13485,-10.39,-3.76,-11.609711860889606
CC(C)Sc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(Br)cc1)C1=C(CCCC1=O)N2,C17113598_decoy,WEE1,Decoy,0.0,-8.56391,-4.99,-3.05,-3.9053037282084135
CC1=C(C#N)c2nc(N)c(C#N)c(C)c2C1=Cc1ccc(-c2ccc(F)cc2)o1,C18270741_decoy,WEE1,Decoy,0.0,-8.85378,-10.01,-0.79,-8.001889423022254
CC(C)(C)[C@@H]1CCc2c(sc3c2C(=O)N[C@H](c2ccc4c(c2)OCO4)N3)C1,C05274740_decoy,WEE1,Decoy,0.0,-9.9378,-5.68,0.14,-4.839051988346306
CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@@H](c2c[nH]c4ccccc24)N3)CC1,C20720052_decoy,WEE1,Decoy,0.0,-7.02284,-10.28,-3.5,-6.025773897259205
Cc1ccc(-c2coc(-c3ccc(NC(=O)Nc4ccc(F)cc4)cc3)n2)cc1,C21363255_decoy,WEE1,Decoy,0.0,-7.87755,-9.14,-2.67,-6.678568037463989
C[C@@H]1CCc2c(sc3nc(SCC(=O)N4CCCC[C@H]4C)nc(N)c23)C1,C23590882_decoy,WEE1,Decoy,0.0,-8.85202,-9.57,-0.87,-7.8539669163397265
CC1(C)C[C@@H](NC(=O)NC2=C(C#N)C3(CCCCC3)Cc3ccccc32)CCO1,C27534100_decoy,WEE1,Decoy,0.0,-9.00355,-6.43,-1.79,-5.116888725185748
C[C@H](Nc1ccc2c(c1)OC1(CCCCC1)O2)C(=O)Nc1ccc(F)cc1F,C28368296_decoy,WEE1,Decoy,0.0,-7.5763,-5.74,-0.61,-4.905735818116115
Cc1ccccc1NC(=O)c1cccc([C@H]2CCCN(C(=O)NC(C)C)C2)c1,C33264252_decoy,WEE1,Decoy,0.0,-8.30836,-9.62,-1.88,-7.879316155665676
CNC(=O)N1CCC[C@@H](c2cccc(C(=O)Nc3ccc(C(C)C)cc3)c2)C1,C33264493_decoy,WEE1,Decoy,0.0,-8.19737,-11.03,-0.81,-9.18220880709233
O=C(Nc1ccc(F)cc1F)Nc1c(-c2ccc(F)cc2)nc2ccccn12,C33312712_decoy,WEE1,Decoy,0.0,-7.44812,-7.93,-1.4,-8.10457800391951
COc1cc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@]32C)cc(Br)c1O,C04322679_decoy,WEE1,Decoy,0.0,-8.49174,-5.25,-2.04,-4.459109358080366
N#CC1=C(N)Oc2cc(OC(=O)c3ccc(F)cc3)ccc2[C@H]1c1cccs1,C38656203_decoy,WEE1,Decoy,0.0,-8.92012,-9.46,-0.38,-8.193432309535455
O=C(Nc1ccc2c(c1)N(C(=O)C1CCCC1)CC2)Nc1c(F)cccc1F,C38709046_decoy,WEE1,Decoy,0.0,-6.66558,-6.64,-0.42,-5.36474351689757
Cc1ccc(SCC2=C3[C@H](c4cccc(F)c4)C(C#N)=C(N)O[C@@H]3N=N2)cc1,C38932073_decoy,WEE1,Decoy,0.0,-8.91768,-8.4,0.06,-8.076976653137207
Cc1ccc(SCC2=C3[C@@H](c4cccc(F)c4)C(C#N)=C(N)O[C@@H]3N=N2)cc1,C38932076_decoy,WEE1,Decoy,0.0,-6.71308,-9.88,-1.47,-7.431927411079994
CC1(C)C[C@H]2C[C@](C)(CN2C(=O)CNC(=O)Nc2cccc3ccccc23)C1,C34932976_decoy,WEE1,Decoy,0.0,-7.66058,-5.8,-0.83,-4.619773973016754
CCNC(=O)c1c(NC(=O)c2cc3cc(C)ccc3o2)sc2c1CCCC2,C41307973_decoy,WEE1,Decoy,0.0,-9.48585,-8.56,-0.8,-8.756171039651882
Cc1ccc(Br)cc1-n1nnnc1-c1ccc(Br)c(N)c1,C42029061_decoy,WEE1,Decoy,0.0,-8.8172,-9.29,-1.21,-8.130801250605062
CC1(C)O[C@@H]2C[C@@H]3[C@H]4CC=C5C[C@H](O)CC[C@]5(C)[C@@H]4CC[C@]3(C)[C@]2(c2ccn[nH]2)O1,C05295854_decoy,WEE1,Decoy,0.0,-6.84835,-5.19,-1.8,-2.708057261209253
C[C@H]1CN(c2ccccc2NC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)C[C@H](C)O1,C47809072_decoy,WEE1,Decoy,0.0,-8.23898,-6.73,-1.41,-3.8066545302733807
O=C(Nc1ccccc1-c1nc2ccccc2s1)C(=O)NC1CCCCC1,C48585751_decoy,WEE1,Decoy,0.0,-7.77814,-5.6,-3.26,-4.796293571873305
O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN(C(=O)Nc2cccs2)C1,C49429256_decoy,WEE1,Decoy,0.0,-9.16931,-6.55,-4.08,-7.168459602012166
CC(C)c1ccc([C@@H]2C3=C(CC(C)(C)CC3=O)Nc3[nH]n(-c4ccccc4)c(=O)c32)cc1,C18195454_decoy,WEE1,Decoy,0.0,-8.0313,-6.43,-4.4,-5.911105997689186
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1,C54620615_decoy,WEE1,Decoy,0.0,-8.20176,-10.51,-2.35,-9.267408511704618
CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc(F)c(Br)c2)NC(=O)N1C,C57458354_decoy,WEE1,Decoy,0.0,-8.87313,-9.0,-2.63,-8.311857264971918
CC(C)(C)OC(=O)N/N=C1\CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C,C05377480_decoy,WEE1,Decoy,0.0,-8.14208,-7.47,-1.85,-3.905318597770816
CC[C@@H](C)NC(=O)c1ccc(NC(=O)N2CC3C[C@@H]4CC2C[C@H](C3)C4)c(C)c1,C62411912_decoy,WEE1,Decoy,0.0,-7.00384,-6.51,-1.3,-4.626398748642286
CCNC(=O)c1ccc(NC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)c(C)c1,C64531536_decoy,WEE1,Decoy,0.0,-8.20469,-9.49,-0.23,-8.36844311771247
Cc1ccc(NC(=O)N2CCC3(CC2)Nc2cc(C)ccc2-n2cccc23)cc1,C35446779_decoy,WEE1,Decoy,0.0,-7.11811,-5.86,-3.71,-3.7472659557465495
Cc1ccccc1CNC(=O)[C@@]1(C)CCCN(C(=O)Nc2ccccc2C)C1,C65058694_decoy,WEE1,Decoy,0.0,-7.7422,-7.29,-2.61,-6.737022499369443
O=C(NNc1ccc(F)cc1)[C@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1,C66606841_decoy,WEE1,Decoy,0.0,-7.21611,-5.55,-3.69,-5.317307969957517
Cc1cc(NC(=O)N2CCC[C@@H](c3ccccc3)CC2)ccc1C(=O)NC(C)C,C66683231_decoy,WEE1,Decoy,0.0,-9.00452,-4.98,-1.91,-5.859602750465476
O=C(C[C@H]1S/C(=N\c2ccc(F)cc2)N(Cc2cccs2)C1=O)Nc1ccc(C(=O)[O-])cc1,C09851026_decoy,WEE1,Decoy,0.0,-10.0088,-5.76,-3.32,-6.155881791411856
C[C@H](Sc1nc2cc(C(=O)[O-])ccc2c(=O)n1-c1ccc(F)cc1)C(=O)NC1CCCCC1,C13016721_decoy,WEE1,Decoy,0.0,-9.0967,-9.62,-2.36,-9.981601544585644
Cc1ccc(-c2cc(NC(=O)CSc3nc(C)cc(C)c3C(=O)[O-])n(-c3ccccc3)n2)cc1,C13022090_decoy,WEE1,Decoy,0.0,-7.95909,-9.24,-1.65,-7.594263340168356
COc1cc(/C=C/C(=O)[O-])cc(S(=O)(=O)N[C@H](C)c2ccccc2Br)c1OC,C13072818_decoy,WEE1,Decoy,0.0,-8.75066,-7.02,-3.69,-7.375826360230712
CC(C)[C@H](NS(=O)(=O)c1ccc(Br)c(C(=O)[O-])c1)c1ccc2c(c1)OCCO2,C13184320_decoy,WEE1,Decoy,0.0,-8.03316,-8.16,-1.18,-8.47984405502964
Cc1ccc(-n2c(SCC(=O)Nc3c(C)cccc3C(=O)[O-])nnc2-c2ccc(Cl)cc2)cc1,C13243360_decoy,WEE1,Decoy,0.0,-9.49857,-6.12,-4.45,-5.7299882986491015
Cc1ccc(-n2c(SCC(=O)Nc3c(C)cccc3C(=O)[O-])nnc2-c2cccc(C)c2)cc1,C13243388_decoy,WEE1,Decoy,0.0,-7.89591,-9.6,-3.07,-6.889915295959995
CCn1c(SCC(=O)Nc2cc3ccccc3cc2C(=O)[O-])nc2sc3c(c2c1=O)CCCC3,C13246132_decoy,WEE1,Decoy,0.0,-8.76366,-7.82,-4.05,-6.41320907188825
O=C([O-])c1cc(Br)ccc1NC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1,C13260378_decoy,WEE1,Decoy,0.0,-7.34544,-9.93,-4.76,-7.690272605017186
Cc1ccc(NC(=O)CSc2nc3cc(C(=O)[O-])ccc3c(=O)n2-c2ccc(F)cc2)c(F)c1,C13266873_decoy,WEE1,Decoy,0.0,-6.94589,-9.54,-5.36,-7.640144413210812
C=CCn1c(SCC(=O)Nc2cc(C(=O)[O-])ccc2C)nnc1-c1ccc(Br)cc1,C13347200_decoy,WEE1,Decoy,0.0,-9.0039,-8.0,-3.25,-7.361436583092942
C[C@@H](Sc1ncc(C(=O)[O-])n1-c1ccc(F)cc1)C(=O)Nc1ccc(N2CCCCC2)cc1,C13352313_decoy,WEE1,Decoy,0.0,-8.20106,-8.92,-1.41,-7.885258412391597
Cc1ccc(-n2c(Cc3ccccc3)nnc2SCC(=O)Nc2cccc(C(=O)[O-])c2)c(C)c1,C13352877_decoy,WEE1,Decoy,0.0,-9.01072,-8.05,-1.77,-8.117222188180753
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)N1CCC(C(=O)N[C@@H](CC(=O)[O-])c2cccs2)CC1,C13389882_decoy,WEE1,Decoy,0.0,-9.32853,-8.23,-2.07,-8.217320679270703
CCn1c(SCC(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)nc2sc3c(c2c1=O)CC[C@@H](C)C3,C13417349_decoy,WEE1,Decoy,0.0,-9.3375,-8.42,-2.29,-9.09088492559976
C=CCO[C@@H]1Oc2ccc(Cl)cc2C(=O)/C1=C/Nc1ccc2nc(SCC(=O)[O-])sc2c1,C19418704_decoy,WEE1,Decoy,0.0,-9.82966,-8.8,-1.99,-8.601195191578727
COc1ccc([C@H](C)NC(=O)c2ccc([N-]S(=O)(=O)c3ccc(C)cc3)c(Cl)c2)cc1OC,C22510573_decoy,WEE1,Decoy,0.0,-9.23664,-8.58,-3.27,-8.009954791170554
COc1ccc(S(=O)(=O)NC2CC2)cc1[N-]S(=O)(=O)c1ccc(Br)cc1Cl,C25369725_decoy,WEE1,Decoy,0.0,-9.37395,-6.82,-4.09,-7.067129949087388
Cn1ccnc1[C@H](NC(=O)Cn1c([S-])nnc1-c1ccc(Cl)cc1)c1ccc(Cl)cc1,C28947619_decoy,WEE1,Decoy,0.0,-9.46446,-9.85,-4.07,-9.900321818163995
Cc1cc([N-]S(=O)(=O)c2cccc(C(=O)Nc3cccc(C4SCCCS4)c3)c2)no1,C29700715_decoy,WEE1,Decoy,0.0,-10.9033,-9.15,-2.93,-8.542012122284072
Cc1ccccc1S(=O)(=O)Nc1cc(C(=O)[O-])ccc1N1CCN(Cc2ccccc2F)CC1,C32962016_decoy,WEE1,Decoy,0.0,-9.02973,-9.44,-1.73,-8.745701177164122
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(N3CC=C(c4ccccc4C)CC3)c(C(=O)[O-])c2)cc1,C32962272_decoy,WEE1,Decoy,0.0,-9.31498,-9.85,-2.54,-8.112464722646168
Cc1cccc(N2CCN(c3ccc(C(=O)[O-])cc3NS(=O)(=O)c3ccc(F)cc3)C[C@@H]2C)c1,C32971158_decoy,WEE1,Decoy,0.0,-9.49768,-7.73,-3.84,-8.155457337221826
CCC(=O)Nc1c(C)noc1/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2Cl)s1,C33306568_decoy,WEE1,Decoy,0.0,-9.06782,-7.42,-1.38,-7.717773016315136
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])Nc3ccccc3F)N2[C@@H]1c1cccc(OC)c1,C34923880_decoy,WEE1,Decoy,0.0,-8.8739,-7.02,-3.66,-7.42806493118675
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@@H]3CCCO3)N2[C@H]1c1ccccc1F,C35701701_decoy,WEE1,Decoy,0.0,-8.45515,-6.98,-2.39,-7.404448985847422
CC1=C(C(=O)N(C)C)[C@@H](c2ccc(F)cc2)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C35702187_decoy,WEE1,Decoy,0.0,-8.70285,-6.76,-1.59,-8.913490402720209
CC1=C(C(=O)OC(C)C)[C@H](c2cccc(F)c2)N2C(/C=C(\[O-])NCc3cccnc3)=CSC2=N1,C35709614_decoy,WEE1,Decoy,0.0,-9.83217,-7.28,-2.75,-7.87154879121501
COC(=O)[C@@H]1C([O-])=NC(SCC(=O)Nc2ccc(C)c(C)c2)=C(C#N)[C@@H]1c1ccc(C(C)C)cc1,C09374567_decoy,WEE1,Decoy,0.0,-6.86421,-8.96,-1.96,-6.390450224334494
COC(=O)[C@@H]1C([O-])=NC(SCC(=O)NCc2ccccc2)=C(C#N)[C@@H]1c1ccc(C(C)C)cc1,C09330077_decoy,WEE1,Decoy,0.0,-8.90637,-8.7,-1.62,-9.677470976083988
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@@H]1c1ccccc1C,C36053129_decoy,WEE1,Decoy,0.0,-8.4232,-6.21,-1.85,-6.939164159640322
CCC1=C(C(=O)OC)[C@@H](c2cc(C)ccc2C)N2C(/C=C(\[O-])NC[C@@H]3CCCO3)=CSC2=N1,C36064710_decoy,WEE1,Decoy,0.0,-7.83378,-8.22,-1.55,-7.993957772635872
CC1=C(C(=O)N(C)C)[C@H](c2ccc(Cl)cc2)N2C(/C=C(\[O-])NCc3ccco3)=CSC2=N1,C36072039_decoy,WEE1,Decoy,0.0,-8.12931,-5.0,-2.02,-5.17821955075999
COc1cc(C(=O)Nc2scc(-c3ccc(Br)cc3)c2C(=O)[O-])cc(OC)c1OC,C01165495_decoy,WEE1,Decoy,0.0,-8.44892,-7.95,-3.23,-7.685225750346064
Cc1nc(SCC(=O)C2=c3ccccc3=[NH+][C@@H]2c2ccc(F)cc2)nc([O-])c1CCC(=O)[O-],C39668086_decoy,WEE1,Decoy,0.0,-8.21613,-9.96,-1.98,-8.053638921898708
CC[C@@H]1CCc2sc(C(=O)Nc3ccc(S(=O)(=O)N4CCC[C@H](C(=O)[O-])C4)cc3)cc2C1,C39689848_decoy,WEE1,Decoy,0.0,-10.3435,-9.49,-1.48,-8.019687569126686
C=CCN1C(=O)[C@@H](CC(=O)Nc2cccc(C(F)(F)F)c2)S/C1=N\c1ccc(C(=O)[O-])cc1,C39843665_decoy,WEE1,Decoy,0.0,-7.64535,-7.72,-1.06,-7.549004765398374
CC(C)c1ccc([C@@H]2C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C([O-])C(=O)N2CCOCCO)cc1,C40095108_decoy,WEE1,Decoy,0.0,-8.99568,-6.92,-3.76,-7.398021722320995
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1ccc(F)cc1,C40400673_decoy,WEE1,Decoy,0.0,-7.61638,-7.24,-2.94,-8.078901346038998
COC(=O)c1c(NC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2Cl)sc2c1CCCC2,C44848602_decoy,WEE1,Decoy,0.0,-9.8738,-9.18,-2.02,-10.516835735701338
Cc1cccc(N2CCN(c3ccc(C(=O)[O-])cc3NS(=O)(=O)c3ccccc3)CC2)c1C,C32961862_decoy,WEE1,Decoy,0.0,-8.94486,-3.12,-3.59,-4.730667461706054
CCn1nc(C)c(C[N-]/C(=N\C(=O)c2cc(C)cc(C)c2)Nc2cc(Cl)ccc2OC)c1C,C32972021_decoy,WEE1,Decoy,0.0,-9.70247,-8.09,-3.36,-9.578700489477628
O=C([O-])c1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccc(F)cc3)/C(=N/c3ccc(F)cc3)S2)cc1,C58944018_decoy,WEE1,Decoy,0.0,-7.76504,-5.11,-1.72,-4.872881038715456
CCN1C(=O)C[C@H](C(=O)Nc2cccc(C(=O)[O-])c2)S/C1=N\c1cccc(C(F)(F)F)c1,C33853396_decoy,WEE1,Decoy,0.0,-7.66892,-9.01,-2.58,-8.353108275262668
CCO/C([O-])=C1/C(C)=NC(SCC(=O)Nc2ccc(C)c(C)c2)=N[C@H]1c1ccccc1OC,C58961604_decoy,WEE1,Decoy,0.0,-9.5273,-8.33,-1.69,-8.630792139154567
O=S(=O)([N-]c1cc(C(F)(F)F)ccc1-n1cccc1)c1ccc(S(=O)(=O)NC2CC2)cc1,C62626121_decoy,WEE1,Decoy,0.0,-9.18375,-6.0,-3.02,-5.96597992555391
O=C([O-])c1ccc(N2C(=O)C[C@@H](S/C(=N\c3ccc(F)cc3)NCc3ccccc3)C2=O)cc1,C18084190_decoy,WEE1,Decoy,0.0,-8.41986,-8.41,-1.8,-8.206165468096847
Cc1ccc(S(=O)(=O)c2[n-]c(-c3ccccc3)nc2SCC(=O)NC[C@H]2CCCO2)cc1,C11695904_decoy,WEE1,Decoy,0.0,-8.00216,-7.67,-3.65,-6.119311756795306
Cc1ccc(S(=O)(=O)c2[n-]c(-c3ccccc3)nc2SCC(=O)Nc2nccs2)cc1,C11695906_decoy,WEE1,Decoy,0.0,-11.5085,-8.21,-4.27,-9.15862935069554
Cc1noc(C)c1CCN(C)c1ccc(C(=O)[O-])cc1NC(=O)c1ccc(Br)cc1,C64820722_decoy,WEE1,Decoy,0.0,-8.53122,-8.99,-3.34,-8.639493015979955
O=C(N/N=C\c1cc([N+](=O)[O-])cc(Br)c1[O-])[C@H]1CC1(c1ccccc1)c1ccccc1,C08386049_decoy,WEE1,Decoy,0.0,-7.20847,-7.73,-1.37,-7.000317073237526
Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2nc3cc(C(=O)[O-])ccc3c(=O)n2-c2ccc(F)cc2)c1,C13016794_decoy,WEE1,Decoy,0.0,-9.43081,-9.71,-0.62,-16.469837104368306
C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1CC(=O)[O-])C(=O)Nc1ccccc1C(F)(F)F,C13019523_decoy,WEE1,Decoy,0.0,-6.98937,-8.19,-4.38,-6.416321887472058
COC(=O)c1c(NC(=O)COc2ccc(C(=O)[O-])cc2Br)sc2c1CCCCC2,C13191173_decoy,WEE1,Decoy,0.0,-8.86227,-7.45,-2.19,-6.865720359317874
CCn1c(SCC(=O)N[C@@H](c2ccc(C)cc2)c2cccs2)nc2cc(C(=O)[O-])ccc2c1=O,C13202573_decoy,WEE1,Decoy,0.0,-8.9703,-8.47,-2.09,-8.576313632718486
Cc1ccc(-c2nnc(SCC(=O)N[C@@H](C)c3ccccc3Br)n2CC(=O)[O-])cc1,C13205930_decoy,WEE1,Decoy,0.0,-7.39108,-7.13,-2.76,-6.695913150002631
C=CCn1c(SCC(=O)Nc2cc3ccccc3cc2C(=O)[O-])nc2sc3c(c2c1=O)CCC3,C13241875_decoy,WEE1,Decoy,0.0,-8.40357,-6.07,-5.22,-5.346062364524333
C=CCn1c(SCC(=O)Nc2cc(F)ccc2C(=O)[O-])nnc1-c1ccc(Cl)cc1Cl,C13243852_decoy,WEE1,Decoy,0.0,-9.73915,-8.68,-5.21,-8.22575685326502
O=C(CSc1nnc(Cc2cccs2)n1-c1ccccc1)Nc1ccc(Cl)cc1C(=O)[O-],C13244541_decoy,WEE1,Decoy,0.0,-8.63108,-5.08,-2.46,-5.187763231944513
O=C([O-])c1ccc(Br)c(S(=O)(=O)N(Cc2ccco2)Cc2ccccc2O)c1,C13251264_decoy,WEE1,Decoy,0.0,-6.65072,-5.59,-1.52,-4.924789699381966
O=C(CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1-c1ccc(F)cc1)Nc1ccc(F)cc1F,C13266507_decoy,WEE1,Decoy,0.0,-6.93737,-9.67,-1.57,-8.607461104302477
C[C@@H](NC(=O)CSc1nc2cc(C(=O)[O-])ccc2c(=O)n1-c1ccccc1F)c1cccs1,C13266642_decoy,WEE1,Decoy,0.0,-9.62836,-9.07,-1.68,-15.206133457306963
C=CCn1c(SCC(=O)Nc2c(Cl)cc(Cl)cc2C(=O)[O-])nnc1-c1ccc(F)cc1,C13348958_decoy,WEE1,Decoy,0.0,-7.79416,-7.78,-3.15,-6.169742121944867
CC[C@@H]1CCc2sc(-c3nnc(SCC(=O)Nc4cc(C(=O)[O-])ccc4C)n3C)cc2C1,C13364826_decoy,WEE1,Decoy,0.0,-10.1121,-8.28,-1.39,-7.418735877893431
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)N1CCC(C(=O)N[C@H](CC(=O)[O-])c2cccs2)CC1,C13389883_decoy,WEE1,Decoy,0.0,-9.85743,-9.5,-3.97,-11.432450040171515
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(I)cc1C(=O)[O-],C13438079_decoy,WEE1,Decoy,0.0,-7.71399,-7.27,-2.32,-6.749343375035689
O=C(C[C@H]1S/C(=N\c2ccc(F)cc2)N(Cc2ccccc2)C1=O)Nc1ccc(C(=O)[O-])cc1,C13879942_decoy,WEE1,Decoy,0.0,-8.14456,-9.09,-2.98,-7.988699108190529
O=C(Nc1cccc(N2CCCC2=O)c1)c1cc2ccccc2cc1[N-]S(=O)(=O)c1cccs1,C22508424_decoy,WEE1,Decoy,0.0,-9.16387,-9.62,-1.76,-9.223262597718389
CCOc1cc2c(cc1CNC(=O)c1ccc([N-]S(=O)(=O)c3cccs3)cc1)O[C@H](C)C2,C24317258_decoy,WEE1,Decoy,0.0,-9.46692,-9.23,-0.2,-13.82817634986007
O=C([O-])c1ccc(N2CCN(c3ccc(Cl)cc3)CC2)c(NS(=O)(=O)c2cccs2)c1,C32961829_decoy,WEE1,Decoy,0.0,-9.33192,-7.98,-2.08,-7.643099094270771
CC(C)c1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2N2CCN(c3ccccc3F)CC2)cc1,C32961952_decoy,WEE1,Decoy,0.0,-8.72024,-6.02,-1.13,-5.875888022718458
Cc1cccc(N2CCN(c3ccc(C(=O)[O-])cc3NS(=O)(=O)c3cc(F)ccc3C)C[C@@H]2C)c1,C32971178_decoy,WEE1,Decoy,0.0,-9.80591,-5.78,-3.53,-5.836162427769995
Cc1ccc(S(=O)(=O)Nc2ccc(N3CCN(c4cccc(C)c4)CC3)cc2C(=O)[O-])cc1,C33006957_decoy,WEE1,Decoy,0.0,-9.23602,-8.86,-3.38,-7.744404762018485
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccc3F)N2[C@@H]1c1ccc(OC)cc1,C34923501_decoy,WEE1,Decoy,0.0,-8.72019,-6.74,-1.68,-7.595055248485605
CCCc1nn(-c2ccc(Cl)cc2)c([O-])c1/C=C1\NC(=O)N(Cc2cccc(F)c2F)C1=O,C35456497_decoy,WEE1,Decoy,0.0,-8.24791,-6.58,-2.87,-5.352954871105544
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3cccnc3)N2[C@H]1c1cc(C)ccc1C,C35693552_decoy,WEE1,Decoy,0.0,-9.29999,-7.33,-2.66,-7.368736626735111
CCC1=C(C(=O)OC)[C@@H](c2ccc(F)cc2)N2C(/C=C(\[O-])NCc3ccncc3)=CSC2=N1,C35696573_decoy,WEE1,Decoy,0.0,-9.49485,-7.95,-2.22,-8.746625470716987
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccncc3)N2[C@H]1c1ccc(C)cc1,C35697237_decoy,WEE1,Decoy,0.0,-9.05014,-7.37,-1.6,-8.684211739133643
COC(=O)[C@H]1C([O-])=NC(SCC(=O)Nc2ccc3ccccc3c2)=C(C#N)[C@H]1c1ccc(C)cc1,C16974723_decoy,WEE1,Decoy,0.0,-6.93132,-9.28,-2.37,-6.781806941962369
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCCc3ccccn3)N2[C@@H]1c1ccccc1F,C36050773_decoy,WEE1,Decoy,0.0,-8.78097,-8.83,-4.39,-9.974999749871078
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1ccc(Cl)cc1,C36050880_decoy,WEE1,Decoy,0.0,-8.98217,-7.13,-2.09,-8.319171356161043
C=CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccco3)N2[C@H]1c1cc(C)ccc1C,C36053266_decoy,WEE1,Decoy,0.0,-8.10759,-6.85,-1.69,-6.404866394939287
COC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NC[C@H]3CCCO3)N2[C@H]1c1ccc(C(C)C)cc1,C36053552_decoy,WEE1,Decoy,0.0,-8.76301,-5.83,-2.78,-6.504516426540501
CCN(CC)C(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCC(C)C)N2[C@H]1c1ccccc1OC,C36053751_decoy,WEE1,Decoy,0.0,-7.16891,-4.3,-3.63,-3.5031854709598385
CC1=C(C(=O)OC(C)(C)C)[C@H](c2ccc(Cl)cc2)N2C(/C=C(\[O-])NC[C@H]3CCCO3)=CSC2=N1,C36061356_decoy,WEE1,Decoy,0.0,-8.87767,-4.97,-3.53,-5.083298155080442
CC1=C(C(=O)N(C)C)[C@@H](c2ccc(Cl)cc2)N2C(/C=C(\[O-])NCCc3ccccn3)=CSC2=N1,C36072034_decoy,WEE1,Decoy,0.0,-8.57514,-4.77,-1.79,-5.2030680697175535
CC1=C(C(=O)N(C)C)[C@@H](c2ccc(Cl)cc2)N2C(/C=C(\[O-])NCc3ccco3)=CSC2=N1,C36072040_decoy,WEE1,Decoy,0.0,-8.99313,-5.41,-1.67,-5.080364233517626
COc1ccc(-c2csc(NC(=O)c3ccccc3[N-]S(=O)(=O)c3ccc(C)cc3)n2)cc1,C08686972_decoy,WEE1,Decoy,0.0,-8.72526,-9.67,-3.09,-8.21403549705038
CC(C)Cn1c(SCC(=O)N[C@@H](C)C23CC4CC(CC(C4)C2)C3)nc2cc(C(=O)[O-])ccc2c1=O,C13048892_decoy,WEE1,Decoy,0.0,-9.23598,-9.18,-6.05,-8.534878305985236
C=CCn1c(SCC(=O)Nc2ccc(Br)cc2C(=O)[O-])nnc1C1CCCCC1,C13342192_decoy,WEE1,Decoy,0.0,-9.38343,-8.22,-2.62,-8.017073377214805
CCOC(=O)[C@@H]1C2=C(CCCC2)S[C@@H]1NC(=O)CSc1nc([O-])cc(-c2ccccc2)n1,C39724666_decoy,WEE1,Decoy,0.0,-9.23995,-9.72,-1.98,-10.46551584150738
CCOC(=O)C1=C(C)N=C2SC=C(/C=C(\[O-])NCc3ccccn3)N2[C@@H]1c1cccc(F)c1,C40400550_decoy,WEE1,Decoy,0.0,-8.80162,-6.23,-2.39,-6.986860044167672
CCCCN1C(=O)c2n[nH]c(-c3cc(Cl)ccc3[O-])c2[C@H]1c1ccc(OCC(C)C)c(OC)c1,C39898517_decoy,WEE1,Decoy,0.0,-10.2039,-8.6,-2.0,-10.779698229404122
O=C([O-])c1cccc(-c2ccc(/C=N/c3sc4c(c3C(=O)NCc3ccco3)CCCC4)o2)c1,C58826712_decoy,WEE1,Decoy,0.0,-10.5571,-9.49,-3.61,-8.92336591630255
COc1ccccc1/C=C/C([O-])=N/C1=NN2C(=NC(c3ccc(Cl)cc3)=C[C@@H]2c2ccc(F)cc2)N1,C02250282_decoy,WEE1,Decoy,0.0,-9.3766,-9.22,-0.89,-7.728868325008302
Cc1cc(C)cc(S(=O)(=O)Nc2ccc(N3CCN(c4cc(C)ccc4C)CC3)c(C(=O)[O-])c2)c1,C32961641_decoy,WEE1,Decoy,0.0,-8.99043,-9.29,-2.89,-7.898831322275923
Cc1nn(C)c(C)c1CCCN(C)c1ccc(NC(=O)c2ccc(Br)cc2)cc1C(=O)[O-],C35510985_decoy,WEE1,Decoy,0.0,-7.59627,-8.31,-2.45,-7.215959744184108
Cc1ccc(C)c(N2CCN(c3ccc(NS(=O)(=O)c4ccc(F)cc4)cc3C(=O)[O-])CC2)c1,C33253006_decoy,WEE1,Decoy,0.0,-8.06399,-9.18,-2.2,-6.799059819943567
CCOC(=O)[C@H]1CCCN(c2ccc(C(=O)[O-])cc2NC(=O)c2ccc(Br)cc2)C1,C64820700_decoy,WEE1,Decoy,0.0,-8.7217,-10.09,-3.04,-9.047553529038968
O=C([O-])c1cc(NS(=O)(=O)c2ccc(C3CCCCC3)cc2)cnc1N1CCCCCCC1,C64843419_decoy,WEE1,Decoy,0.0,-8.66375,-9.96,-2.92,-8.14596364406619
CCN(CC)c1ccc2cc(C(N)=O)/c(=N/c3cc(C(F)(F)F)ccc3N3CCCCC3)oc2c1,C02699159_decoy,WEE1,Decoy,0.0,-9.35365,-5.06,-0.66,-6.622986335315514
COc1c(C)cc(Br)cc1C(=O)Nc1ccc(NC(=O)c2cc3ccccc3o2)c(C)c1,C08900950_decoy,WEE1,Decoy,0.0,-9.21093,-10.83,-2.01,-8.714761919750432
CC[C@]1(C)Cc2c(sc3nc(SCC(=O)N(c4ccccc4)c4ccccc4)nc(N)c23)CO1,C02242418_decoy,WEE1,Decoy,0.0,-11.196,-8.85,-0.63,-9.128942393271872
Cc1cc2nn(-c3ccc(C(C)C)cc3)nc2cc1NC(=S)NC(=O)c1ccc(Cl)cc1Cl,C14275800_decoy,WEE1,Decoy,0.0,-10.4451,-9.02,-2.24,-10.968416125566486
Cc1ccc(-n2c(SCc3ccccc3)nnc2[C@@H](C)NC(=O)Nc2cccc3ccccc23)cc1,C16568881_decoy,WEE1,Decoy,0.0,-7.61039,-7.82,-1.37,-6.828072449240255
Cc1ccc(-n2c(SCc3ccc(F)cc3)nnc2[C@H](C)NC(=O)Nc2cccc(Cl)c2)cc1,C16568918_decoy,WEE1,Decoy,0.0,-8.44363,-8.15,-4.65,-7.054856789777159
COc1cc([C@@H]2C(C(=O)OC3CCCC3)=C(C)NC3=C2C(=O)CC(C)(C)C3)cc(Br)c1O,C00626669_decoy,WEE1,Decoy,0.0,-8.09061,-4.69,-3.3,-5.668988904963547
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccccc2F)n2nc(SCc3cccc(C)c3)nc2N1,C20181690_decoy,WEE1,Decoy,0.0,-9.65125,-9.82,-3.2,-8.151926375821578
CC(C)COc1ccc([C@@H]2CC(=O)C3=C(C2)Nc2ccccc2N[C@H]3c2ccc3c(c2)OCO3)cc1,C20885412_decoy,WEE1,Decoy,0.0,-9.49041,-4.56,-2.95,-5.172341823907539
CCOC(=O)c1ccc2[nH]/c(=N\C(=S)NC(=O)c3cccc(I)c3)sc2c1,C20974596_decoy,WEE1,Decoy,0.0,-9.79193,-8.87,-2.24,-7.868413404291275
O=C(Nc1ccc2c(c1)CCCN2S(=O)(=O)c1ccccc1)NC(c1ccccc1)c1ccccc1,C22505006_decoy,WEE1,Decoy,0.0,-8.51865,-9.92,-2.83,-7.582279439534703
Cc1ccc(NC(=O)/C(=C/c2ccc3c(c2)OCO3)NC(=O)c2ccc(Cl)cc2Cl)cc1C,C26804535_decoy,WEE1,Decoy,0.0,-9.29649,-6.38,-4.27,-5.822061957378726
COC(=O)c1ccc(NC(=O)/C(=C/c2ccc(Br)cc2)NC(=O)c2ccc(C)cc2)cc1,C27520998_decoy,WEE1,Decoy,0.0,-8.38332,-9.31,-2.11,-7.629547872486795
COc1ccc(/C=C(/NC(=O)c2ccc(Br)cc2)C(=O)Nc2ccc(C)cc2C)c(OC)c1,C28308813_decoy,WEE1,Decoy,0.0,-8.90158,-8.38,-2.89,-8.014285388098953
O=C(Nc1ccc2ccccc2c1)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1ccc(Br)cc1,C28308920_decoy,WEE1,Decoy,0.0,-9.4553,-10.03,-2.69,-10.122051438526682
Cc1cc(C)c(C)c(O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(Br)cc3)cc2)c1,C30757066_decoy,WEE1,Decoy,0.0,-9.39414,-9.4,-4.02,-9.141250495513804
COC(=O)c1ccc([C@@H]2Nc3ccc(S(=O)(=O)Nc4ccc(C)cc4C)cc3[C@H]3C=CC[C@H]32)cc1,C32181015_decoy,WEE1,Decoy,0.0,-9.69911,-10.44,-1.59,-10.287931323688424
CCN1C(=S)N[C@@H](c2ccc(NC(=O)c3ccc(-c4ccccc4)cc3)cc2)C(C(=O)OC)=C1C,C34716218_decoy,WEE1,Decoy,0.0,-7.75134,-9.84,-1.84,-7.6452868800898
Cc1ccccc1CC(=O)N1CCN(c2ccc(NC(=O)NC34CC5CC(CC(C5)C3)C4)cc2)CC1,C35338193_decoy,WEE1,Decoy,0.0,-9.66566,-10.53,-4.92,-5.638094165506382
CC1=C(C(=O)OCC(C)C)[C@H](c2ccc(NC(=O)C34CC5CC(CC(C5)C3)C4)cc2)NC(=S)N1C,C35352454_decoy,WEE1,Decoy,0.0,-8.34366,-8.36,-3.42,-7.738018399208177
CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc(NC(=O)C34CC5CC(CC(C5)C3)C4)cc2)NC(=S)N1C,C35352455_decoy,WEE1,Decoy,0.0,-7.62412,-8.73,-4.37,-7.1205711066308
CC(C)c1ccc(NC(=O)Nc2ccc3c(c2)CN(Cc2cccc(C(F)(F)F)c2)C(=O)[C@H](C)O3)cc1,C35886246_decoy,WEE1,Decoy,0.0,-9.82195,-10.85,-4.53,-9.57512335662302
COc1cc([C@H]2Nc3ccc(NC(=O)c4ccc(C(C)(C)C)cc4)cc3[C@H]3C=CC[C@@H]32)ccc1OC(C)=O,C36557273_decoy,WEE1,Decoy,0.0,-8.82851,-6.89,-1.78,-6.010745007269896
C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(C(C)(C)C)cc1,C38649799_decoy,WEE1,Decoy,0.0,-8.52881,-9.45,-1.68,-7.047080065090999
C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(C(C)(C)C)cc1,C38649801_decoy,WEE1,Decoy,0.0,-8.5083,-9.06,-1.99,-8.065391503160043
CC(C)c1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)cc1,C38651416_decoy,WEE1,Decoy,0.0,-10.0424,-9.14,-1.19,-8.518370544826617
CCc1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2Cl)cc1,C38655584_decoy,WEE1,Decoy,0.0,-8.82154,-10.59,-1.41,-7.694386435919447
CCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1Br,C38678932_decoy,WEE1,Decoy,0.0,-7.99352,-6.58,-3.34,-5.139458997925828
CC(C)Oc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2c(F)cccc2Cl)cc1,C38680401_decoy,WEE1,Decoy,0.0,-8.10228,-6.37,-1.56,-5.057904874947538
CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4Br)ccc32)c1,C38684375_decoy,WEE1,Decoy,0.0,-9.57924,-6.21,-0.93,-5.370473073960219
C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(Br)cc4)ccc32)c1,C38684517_decoy,WEE1,Decoy,0.0,-8.83269,-8.74,-1.43,-8.0909054092105
N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3F)ccc2[C@H]1c1cccc(OCc2ccc(F)cc2)c1,C38686878_decoy,WEE1,Decoy,0.0,-9.81199,-9.16,-2.04,-8.167528913851225
COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Br)cc2)cc1Cl,C38687909_decoy,WEE1,Decoy,0.0,-9.6611,-11.1,-3.0,-9.6949679338789
CSc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4oc5cc(C)ccc5c4C)ccc32)cc1,C38700693_decoy,WEE1,Decoy,0.0,-7.95263,-11.14,-1.19,-8.074529303528122
CCc1ccccc1-n1nc(C(=O)N[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)C2)cc1-c1ccc2c(c1)CCCC2,C39197465_decoy,WEE1,Decoy,0.0,-9.02337,-7.34,-3.67,-6.427202589969376
Cc1ccc(C2=NN=C3OC(N)=C(C#N)[C@@H](c4ccccc4OCc4ccc(Cl)cc4)[C@H]32)cc1C,C00664726_decoy,WEE1,Decoy,0.0,-5.62498,-4.15,-2.69,-2.6803916119770395
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(Cl)cc2)n2nc(SCc3ccccc3F)nc2N1,C40902616_decoy,WEE1,Decoy,0.0,-9.71752,-9.39,-2.97,-7.736889261630291
CCCSc1nc2n(n1)[C@H](c1cccc3ccccc13)C(C(=O)Nc1cccc(C)c1C)=C(C)N2,C41022894_decoy,WEE1,Decoy,0.0,-7.97216,-5.8,-1.87,-5.50520818245788
Cc1cc(C)c2nc(NC(=O)c3cc(S(=O)(=O)NC4CCCC4)c(Cl)cc3Cl)sc2c1,C47156475_decoy,WEE1,Decoy,0.0,-10.6858,-9.32,-3.47,-9.558960653040806
Cc1ccc2nc(-c3ccc(NC(=O)[C@@H]4CCCN(C(=O)NCc5cccs5)C4)cc3)sc2c1,C49425712_decoy,WEE1,Decoy,0.0,-10.8348,-8.91,-4.08,-10.660953489764813
CC1=C(C(=O)Nc2cccc(C)c2)[C@H](c2ccc(F)cc2)n2nc(SCc3ccccc3)nc2N1,C54642826_decoy,WEE1,Decoy,0.0,-9.25039,-9.56,-3.2,-7.850084131347699
CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2sccc2C)n2nc(SCc3ccccc3)nc2N1,C54643818_decoy,WEE1,Decoy,0.0,-8.68805,-6.03,-3.13,-5.04551304569471
COC(=O)c1ccc([C@H]2Nc3ccc(S(=O)(=O)Nc4cc(Cl)ccc4C)cc3[C@H]3C=CC[C@H]32)cc1,C58848166_decoy,WEE1,Decoy,0.0,-9.30893,-8.86,-3.92,-7.430416274935921
CCOc1ccc([C@H]2Nc3ccc(S(=O)(=O)Nc4cc(Cl)ccc4OC)cc3[C@H]3C=CC[C@H]32)cc1,C58849665_decoy,WEE1,Decoy,0.0,-9.74165,-8.92,-2.24,-11.427112965066614
C[C@H](Sc1nc2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2s1)C(=O)Nc1nccs1,C59489626_decoy,WEE1,Decoy,0.0,-9.29691,-8.59,-1.85,-7.559458102378676
O=C(N/N=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1,C59960710_decoy,WEE1,Decoy,0.0,-8.87604,-10.44,-0.89,-7.809942743210199
CCOc1ccc([C@H]2NN(c3ccccc3)C=C2/C=C/[C@]23NC(=O)CCN2c2ccccc2C3(C)C)cc1,C09309067_decoy,WEE1,Decoy,0.0,-8.01393,-8.79,-2.83,-6.887158404867556
N#CC1=C(N)OC2=NN=C(c3ccc4ccccc4c3)[C@H]2[C@@H]1c1cccc(OCc2ccccc2F)c1,C00623048_decoy,WEE1,Decoy,0.0,-8.15337,-10.18,-0.92,-8.345002613774902
N#CC1=C(N)OC2=NN=C(c3ccc(Cl)cc3)[C@@H]2[C@H]1c1cccc(OCc2ccccc2Cl)c1,C20495152_decoy,WEE1,Decoy,0.0,-9.00096,-9.16,-1.71,-9.684391378270512
Cc1ccc(-c2csc3c(=O)[nH]c(N4CCC[C@H](C(=O)N[C@@H](C)c5ccc(F)cc5)C4)nc23)cc1,C49421300_decoy,WEE1,Decoy,0.0,-8.86649,-5.65,-1.28,-4.880679316161086
CC[C@@H](C[NH+](C)Cc1ccccc1)NC(=O)c1ccc(N2CCOc3ccc(Cl)cc32)s1,C08912120_decoy,WEE1,Decoy,0.0,-9.32196,-7.45,-2.63,-7.571965785963925
O=C([C@@H]1Cc2ccccc2C[NH+]1Cc1ccc(O)cc1)N(CCc1ccccc1)Cc1ccccc1,C09763519_decoy,WEE1,Decoy,0.0,-8.41537,-10.49,-2.05,-9.803697483789076
CC[NH+]1CCc2c(sc(NC(=O)Cc3cc(C)ccc3C)c2-c2nc3ccccc3s2)C1,C10698118_decoy,WEE1,Decoy,0.0,-8.24526,-10.34,-1.81,-8.688652989359342
CCOC(=O)C[NH+]1[C@@H](c2ccccc2)c2cc(Br)ccc2N[C@H]1c1ccccc1F,C11667229_decoy,WEE1,Decoy,0.0,-8.1386,-4.44,-3.1,-5.527549338223355
CSc1ccc(NC(=O)[C@@H]2CC23CC[NH+](C[C@@H](C)Cc2ccc4c(c2)OCO4)CC3)cc1,C11981010_decoy,WEE1,Decoy,0.0,-9.42207,-8.48,-1.64,-8.337998340439004
Cc1ccc([C@@H](c2c(NC(=O)c3ccco3)sc(C)c2C)[NH+]2CCC(Cc3ccccc3)CC2)cc1,C02667940_decoy,WEE1,Decoy,0.0,-8.07974,-9.14,-2.51,-8.07357627997994
COc1ccccc1NC(=O)[C@@H]1CC12CC[NH+](Cc1ccc(OCc3ccccc3)cc1)CC2,C12042755_decoy,WEE1,Decoy,0.0,-7.52401,-9.65,-2.24,-7.504432340309609
Cc1ccc(C)c(N2CCN(C(=S)Nc3ccc4[nH+]c(N5CCCC5)cc(C)c4c3)CC2)c1,C20183141_decoy,WEE1,Decoy,0.0,-10.7714,-9.39,-2.66,-9.452193677308465
O[C@@H](COc1ccccc1Br)CN1CC[NH+](C(c2ccccc2)c2ccccc2)CC1,C20321887_decoy,WEE1,Decoy,0.0,-9.46461,-5.41,-1.76,-6.113409205902397
C[C@@H]1[C@H](C)CCC[C@H]1NC(=O)C1CCN(c2[nH+]c3ccccc3n2Cc2ccccc2F)CC1,C21162459_decoy,WEE1,Decoy,0.0,-8.54968,-6.06,-4.32,-5.459927845522537
Cc1ccccc1Cn1c(N2CCC(C(=O)N[C@H](C)C34CC5CC(CC(C5)C3)C4)CC2)[nH+]c2ccccc21,C21163011_decoy,WEE1,Decoy,0.0,-9.20154,-9.16,-3.76,-7.017847791391096
O=C(NCc1ccccc1)C1CC[NH+](Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1,C22516137_decoy,WEE1,Decoy,0.0,-8.45336,-9.6,-5.75,-9.722260734669137
O=C(CN1CCC[NH+](Cc2ccc(F)cc2)CC1)N[C@@H](c1ccc(F)cc1)c1cccs1,C25072353_decoy,WEE1,Decoy,0.0,-10.0096,-5.54,-3.21,-6.539823075381572
O=C(C[C@@H](c1ccccc1F)c1cnc2ccc(Cl)cn12)NC1CC[NH+](Cc2ccccc2)CC1,C35363689_decoy,WEE1,Decoy,0.0,-9.16443,-8.78,-3.25,-9.141519826039652
C[C@@H](CCc1ccccc1)NC(=O)c1ccc(C[NH+]2CCn3cccc3[C@@H]2c2ccc(F)cc2F)o1,C35523524_decoy,WEE1,Decoy,0.0,-8.00089,-5.99,-2.03,-5.769747823507805
O=C(NCc1ccccc1F)[C@@H]1Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C3CCCCC3)C[C@H]12,C35872002_decoy,WEE1,Decoy,0.0,-8.94714,-6.71,-3.17,-5.941585388069351
COc1ccccc1[C@@H](c1c(NC(=O)c2ccco2)sc2c1CCCC2)[NH+]1CCC(C)CC1,C38546313_decoy,WEE1,Decoy,0.0,-8.07131,-4.28,-2.8,-5.161295533730252
O=C(/N=C1/N=[NH+][C@@H](c2ccccc2SCc2ccccc2F)S1)Nc1ccc(Cl)cc1Cl,C39029782_decoy,WEE1,Decoy,0.0,-6.56412,-6.94,-1.46,-4.648339603672941
Cc1ccc(NC(=O)/N=C2/N=[NH+][C@@H](c3ccccc3SCc3ccccc3F)S2)cc1C,C39034820_decoy,WEE1,Decoy,0.0,-9.3004,-6.12,-3.04,-5.57085291214083
Cc1ccc(NC(=O)/N=C2/N=[NH+][C@H](c3ccccc3SCc3ccc(F)cc3)S2)cc1C,C39037457_decoy,WEE1,Decoy,0.0,-8.85322,-6.0,-1.99,-5.719186188747945
O=C(Nc1cccc2c1CCCC2)C1CC[NH+](Cc2c(-c3ccccc3)nc3ccccn23)CC1,C39198218_decoy,WEE1,Decoy,0.0,-7.82434,-9.89,-1.41,-9.203282425619369
CC(C)[NH+]1CCC2(CC1)CC(=O)c1cc(-c3cccc(C(=O)Nc4ccccc4)c3)ccc1O2,C39227442_decoy,WEE1,Decoy,0.0,-8.63778,-9.89,-1.68,-7.584424394488459
O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCC[NH+]1Cc1cccc(Oc2ccccc2)c1,C39266348_decoy,WEE1,Decoy,0.0,-8.08573,-11.13,-3.32,-12.978252294306174
CSc1ccc([C@H](c2c(NC(=O)c3ccccc3)sc(C)c2C)N2CC[NH+](C)CC2)cc1,C22917874_decoy,WEE1,Decoy,0.0,-7.26457,-4.65,-2.77,-4.570807887583334
CC(C)(O)C#Cc1ccc(C[NH+]2CCC(C3=NN=C[C@@H]3c3cccc(C(F)(F)F)c3)CC2)cc1,C39442270_decoy,WEE1,Decoy,0.0,-8.75723,-8.46,-3.24,-6.14387330389243
CC(C)(O)C#Cc1ccc(C[NH+]2CCC[C@@H](C3=NN=C[C@@H]3c3cccc(C(F)(F)F)c3)C2)cc1,C39508497_decoy,WEE1,Decoy,0.0,-9.72695,-8.97,-2.14,-8.156827076416903
CC(=O)Nc1sc2c(c1[C@@H](c1ccc(F)cc1)[NH+]1CCN(c3ccccc3)CC1)CCCC2,C39853471_decoy,WEE1,Decoy,0.0,-7.52906,-8.71,-2.32,-7.113299370270865
Cc1ccc2cc3c([nH+]c2c1)N(c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1)CC3,C39881451_decoy,WEE1,Decoy,0.0,-8.00328,-10.62,-2.13,-7.3803425963003395
CSc1ccc([C@H](c2oc3ccccc3c2NC(=O)c2cccs2)N2CC[NH+](C)CC2)cc1,C22938251_decoy,WEE1,Decoy,0.0,-10.1773,-5.27,-4.0,-5.9241740612692775
CC1CCN(c2ccc([C@@H](C)NC(=O)[C@@H]3CCC[NH+](Cc4cccc5ccccc45)C3)cc2)CC1,C44854146_decoy,WEE1,Decoy,0.0,-10.3506,-10.53,-1.57,-9.71357846448278
CCOc1cccc(C[NH+]2CCC(C(=O)N[C@H](C)c3ccc(N4CCC[C@H](C)C4)cc3)CC2)c1,C44854971_decoy,WEE1,Decoy,0.0,-8.72265,-8.53,-4.27,-8.939169961219939
C[C@@H]1CCCN(c2ccc([C@@H](C)NC(=O)[C@@H]3CCC[NH+](Cc4cccc5ccccc45)C3)cc2)C1,C44855012_decoy,WEE1,Decoy,0.0,-9.00071,-10.07,-3.47,-9.965117750202053
O=C(NCc1ccc(OCc2ccc(F)cc2)cc1)[C@H]1CCC[NH+](Cc2ccc(Cl)cc2)C1,C44905374_decoy,WEE1,Decoy,0.0,-7.83535,-6.14,-2.81,-4.541679693362214
Cc1ccccc1C[NH+]1CCC[C@H](C(=O)Nc2cccc(C(=O)c3ccc(C(C)(C)C)cc3)c2)C1,C44938759_decoy,WEE1,Decoy,0.0,-9.17638,-10.37,-3.63,-8.568410422720374
O=C(c1ccc2ccccc2c1)N(Cc1ccc(F)cc1)c1cc[nH+]c(NC2CCCCC2)c1,C49072659_decoy,WEE1,Decoy,0.0,-8.30186,-9.45,-0.49,-8.255296565573229
CCOC(=O)c1ccc(N2Cc3ccccc3/C(=C\c3ccc(Br)cc3)C2=[NH2+])cc1,C31776101_decoy,WEE1,Decoy,0.0,-9.48922,-9.28,-2.88,-17.557128586965657
O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)c1ccc(C[NH+]2CCc3ccccc3C2)cc1,C20243990_decoy,WEE1,Decoy,0.0,-8.91707,-9.7,-1.69,-7.89986423844172
COc1ccc([C@H]2NCCC3=c4ccccc4=[NH+][C@H]32)cc1COc1ccc(Br)cc1,C63350181_decoy,WEE1,Decoy,0.0,-7.87481,-8.92,-0.98,-8.120011616269228
COc1ccc([C@H]2NCCC3=c4ccccc4=[NH+][C@H]32)cc1COc1ccccc1C1CCCCC1,C63354680_decoy,WEE1,Decoy,0.0,-8.17075,-10.13,-4.19,-7.812872800583103
COc1c(C)cc(S(=O)(=O)NCCC2=c3cc(Br)ccc3=[NH+][C@H]2C)c(C)c1C,C63515228_decoy,WEE1,Decoy,0.0,-8.86258,-8.82,-1.4,-8.250396362747384
C[C@@H](NC(=O)[C@@H]1[NH+]=c2ccccc2=C1Sc1ccc(Cl)cc1)c1ccc2c(c1)OCCO2,C63530470_decoy,WEE1,Decoy,0.0,-8.89372,-8.77,-3.86,-6.7850104297768885
CC1=CC2=N[C@H](C(=O)NCCC3=c4ccccc4=[NH+]C3)[C@@H](Sc3ccc(Cl)cc3)[C@@H]2C=C1,C63530630_decoy,WEE1,Decoy,0.0,-9.97591,-9.11,-3.01,-10.252684929703934
COc1ccc2c(c1)=[NH+][C@@H](C(=O)NCc1ccccc1Br)C=2Sc1ccccc1,C63531064_decoy,WEE1,Decoy,0.0,-8.30822,-7.72,-2.61,-7.357867808207968
COc1ccc2c(c1)=[NH+][C@@H](C(=O)NCc1ccc(OC(C)C)cc1)C=2Sc1ccc(C)cc1,C63531329_decoy,WEE1,Decoy,0.0,-8.22732,-8.18,-4.07,-7.677975233023669
FC(F)(F)Oc1ccccc1NC(=S)N1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1C(F)(F)F,C63608940_decoy,WEE1,Decoy,0.0,-7.08348,-4.97,-2.3,-4.369534101052688
CCc1ccc2c(c1)[C@@H](c1ccc(Cl)cc1)[C@H](C(=O)NCCC1=c3ccccc3=[NH+]C1)N2C,C63980332_decoy,WEE1,Decoy,0.0,-9.15606,-8.07,-1.53,-7.819563346563065
C[NH+]1CCc2c(sc3c2CN(C(=O)NCCc2ccccc2)[C@@H](c2ccc(F)cc2)c2cccn2-3)C1,C35427274_decoy,WEE1,Decoy,0.0,-8.82097,-4.76,-2.22,-5.450883886343637
C[NH+]1CCc2c(sc3c2CN(C(=O)NCCc2ccccc2)[C@H](c2ccc(F)cc2)c2cccn2-3)C1,C35427276_decoy,WEE1,Decoy,0.0,-6.8231,-6.81,-3.35,-5.194672072643061
CC[NH+]1CCC2(CC1)N=C(SCC(=O)Nc1cccc(C)c1)C(c1ccc(Br)cc1)=N2,C35397202_decoy,WEE1,Decoy,0.0,-9.61703,-9.32,-2.02,-8.550247129781642
COc1ccc2cc3cc(C(=O)NC[C@@H]4CC[NH+](Cc5ccc(C)cc5)C4)sc3nc2c1Cl,C65330828_decoy,WEE1,Decoy,0.0,-10.6667,-8.92,-2.11,-8.12529254960353
CC(=O)Nc1ccc2c(c1)[C@@H]1[C@@H](Cl)[C@@H](Sc3ccccc3[N+](=O)[O-])C[C@H]1[C@H](c1ccccc1F)N2,C04063778_decoy,WEE1,Decoy,0.0,-6.27139,-8.97,-1.87,-7.1906109012492685
N#Cc1c(NC(=O)C2CCC(C(=O)Nc3sc4c(c3C#N)CCCCC4)CC2)sc2c1CCCCC2,C03258698_decoy,WEE1,Decoy,0.0,-9.71222,-9.03,-2.69,-7.401050095478531
N#Cc1c(NC(=O)c2ccc(Cl)c(S(=O)(=O)Nc3cc(Cl)ccc3Cl)c2)sc2c1CCC2,C03299182_decoy,WEE1,Decoy,0.0,-10.6225,-10.33,-2.57,-12.64888209710391
COc1ccc(C(=O)NC(=S)Nc2ccc3oc(-c4ccccc4C)nc3c2)cc1Br,C00724619_decoy,WEE1,Decoy,0.0,-11.1254,-5.53,-2.69,-6.900171729966904
O=C(NC1CCCCC1)[C@H](CCO)Sc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCCC3,C00723944_decoy,WEE1,Decoy,0.0,-10.7758,-8.82,-4.86,-9.121458054197957
COC(=O)c1c(NC(=O)c2ccc(F)cc2)sc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1C,C08926601_decoy,WEE1,Decoy,0.0,-9.0639,-9.15,-3.36,-15.280341484059804
Cc1ccc([C@H]2Nn3c(nnc3-c3ccccc3)S[C@@H]2C(=O)Nc2ccccc2C(F)(F)F)cc1,C09238155_decoy,WEE1,Decoy,0.0,-9.84659,-9.44,-0.71,-9.170168672276487
Cc1cc(C)c(C(=O)Nc2cccc(Cl)c2)c(SCC(=O)Nc2nc3ccccc3s2)n1,C09250233_decoy,WEE1,Decoy,0.0,-9.22533,-8.72,-3.87,-8.172039902121677
O=C(Nc1ccccc1C(=O)Nc1ccccc1)c1ccc(OC[C@H]2CCCO2)c(Br)c1,C09925431_decoy,WEE1,Decoy,0.0,-10.3529,-6.47,-1.78,-6.9621254916777735
O=C(Nc1ccccc1C(=O)NC1CCCCC1)c1ccc(OC[C@@H]2CCCO2)c(Br)c1,C09925540_decoy,WEE1,Decoy,0.0,-9.05119,-9.64,-1.85,-8.798620357265952
O=C(Nc1ccc(F)c(F)c1)c1oc2ccccc2c1NC(=O)C1c2ccccc2Oc2ccccc21,C10246272_decoy,WEE1,Decoy,0.0,-7.9474,-7.14,-4.68,-5.937246847265864
N#CC1=C(N)N(c2nnc(SCc3ccccc3Cl)s2)C2=C(C(=O)CCC2)[C@H]1c1ccccc1,C12376102_decoy,WEE1,Decoy,0.0,-9.88248,-6.07,-1.6,-6.141935132864461
O=C(NC1CCCCC1)C(=Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)NC1CCCCC1,C12604180_decoy,WEE1,Decoy,0.0,-8.53326,-6.16,-4.57,-5.202481236100489
O=C(Nc1ccccc1F)C(=O)N(C1CCCCC1)[C@H](C(=O)NC1CCCC1)c1ccccc1F,C12641843_decoy,WEE1,Decoy,0.0,-8.85811,-4.35,-4.3,-5.434762488649856
C[C@@H]1CCc2c(sc3nc(SCCC(=O)N4CCN(c5ccc(F)cc5)CC4)nc(N)c23)C1,C12521509_decoy,WEE1,Decoy,0.0,-10.1714,-8.62,-2.73,-7.018646874333135
C[C@H]1CCc2c(sc3nc(SCCC(=O)N4CCN(c5ccc(F)cc5)CC4)nc(N)c23)C1,C12521510_decoy,WEE1,Decoy,0.0,-10.3125,-9.65,-1.43,-12.862863585143144
O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc(S(=O)(=O)NC2CC2)ccc1Br,C12932265_decoy,WEE1,Decoy,0.0,-9.51992,-9.53,-0.07,-14.879426167185636
CN(C)c1ccc([C@@H]2C3=C(CC(C)(C)CC3=O)Nc3nc(SCc4ccccc4F)[nH]c(=O)c32)cc1,C09781058_decoy,WEE1,Decoy,0.0,-9.7263,-6.11,-1.35,-5.464309748752789
O=C(NC[C@H]1CCCO1)/C(=C/c1ccc(-c2ccc(Cl)cc2)o1)NC(=O)c1ccc(Cl)cc1,C02319341_decoy,WEE1,Decoy,0.0,-9.18317,-8.46,-1.36,-8.539199746705615
O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1nnc(-c2ccc(Br)cc2)s1)c1cccs1,C16571461_decoy,WEE1,Decoy,0.0,-9.31924,-7.7,-4.43,-7.6852027901396145
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@@H]1c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1,C16609132_decoy,WEE1,Decoy,0.0,-8.70627,-8.13,-4.14,-7.36025819317363
CCOC(=O)C1=C(C)N(CC)C(=S)N[C@H]1c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1,C16609134_decoy,WEE1,Decoy,0.0,-9.02181,-5.9,-4.23,-5.293531654965923
CC1=C(C(=O)Nc2ccccc2)[C@H](c2cccc(NC(=O)c3ccc(C)cc3)c2)N2CCCSC2=N1,C16613672_decoy,WEE1,Decoy,0.0,-9.6304,-10.99,-2.42,-9.552394769148576
COc1ccc([C@H]2CC(=O)C3=C(C2)NC(C)=C(C(=O)Nc2ccc(C)cc2)[C@@H]3c2ccsc2)cc1OC,C13081086_decoy,WEE1,Decoy,0.0,-8.60379,-4.88,-1.59,-5.306925319810062
COC(=O)c1c(NC(=O)C2=C(C)NC3=C(C(=O)CC(C)(C)C3)[C@@H]2c2ccccc2)sc2c1CCCC2,C19858033_decoy,WEE1,Decoy,0.0,-9.17768,-8.98,-3.37,-7.107708825040093
CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc3c(c2)OCO3)C2=C(C[C@@H](c3cccs3)CC2=O)N1,C12416322_decoy,WEE1,Decoy,0.0,-7.61907,-5.51,-4.03,-4.918976941235726
COc1cccc([C@@H]2C(C(=O)Nc3ccccc3)=C(C)NC3=C2C(=O)C[C@@H](c2cccs2)C3)c1OC,C12416365_decoy,WEE1,Decoy,0.0,-8.20883,-5.52,-2.26,-5.284965296672975
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc3c(c2)OCO3)C2=C(C[C@@H](c3cccs3)CC2=O)N1,C01427803_decoy,WEE1,Decoy,0.0,-9.00474,-6.13,-2.27,-5.637183920941307
CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccco2)C(C#N)=C(SCC(=O)c2ccc(C)cc2)N1,C20170508_decoy,WEE1,Decoy,0.0,-8.49064,-9.25,-1.79,-10.267277502924289
COc1ccc([C@H]2CC(=O)C3=C(C2)NC(C)=C(C(=O)Nc2ccc(C)cc2)[C@H]3c2ccc(C)s2)cc1OC,C09598267_decoy,WEE1,Decoy,0.0,-8.37848,-5.57,-2.19,-5.3724245069550856
CCc1ccc([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(Cc2ccc(F)cc2)c2ccccc23)cc1,C20558487_decoy,WEE1,Decoy,0.0,-9.22247,-5.67,-2.6,-6.357404271594547
Cc1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)cc1,C22510964_decoy,WEE1,Decoy,0.0,-7.47876,-10.17,-2.73,-7.283888863653369
Cc1ccsc1/C=N/NC(=O)c1cc2n(n1)[C@H](C(F)(F)C(F)(F)F)C[C@H](c1ccc(F)cc1)N2,C22824109_decoy,WEE1,Decoy,0.0,-7.81276,-8.63,-0.93,-8.22690959207494
C/C(=N/NC(=O)C1CCC(C(C)(C)C)CC1)c1cccc(NC(=O)c2ccc(Br)o2)c1,C22746205_decoy,WEE1,Decoy,0.0,-9.12597,-9.27,-2.75,-7.166742449783954
Cc1ccccc1NC(=O)Nc1ccc(N2CCC(Cc3ccccc3)CC2)c(C(=O)N2CCCC2)c1,C00735874_decoy,WEE1,Decoy,0.0,-8.92475,-9.4,-3.16,-7.008297389879467
Cc1cc(C)nc(N[C@H](c2ccc(C(F)(F)F)cc2)c2cc(C)sc2NC(=O)c2ccco2)n1,C38547999_decoy,WEE1,Decoy,0.0,-7.95941,-9.06,-2.19,-8.82695959348748
CCc1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Br)cc2)cc1,C38651787_decoy,WEE1,Decoy,0.0,-9.15077,-9.8,-1.28,-8.782011904048117
CCc1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2Br)cc1,C38678908_decoy,WEE1,Decoy,0.0,-9.95806,-9.01,-1.42,-8.805999314693235
N#CC1=C(N)Oc2cc(OC(=O)c3sc4cccc(Cl)c4c3Cl)ccc2[C@H]1c1ccco1,C38688477_decoy,WEE1,Decoy,0.0,-9.69884,-10.43,-1.34,-8.145625984053648
N#C/C(=C\c1ccc(Cl)cc1Cl)C(=O)Nc1sc2c(c1C(=O)NC[C@@H]1CCCO1)CCCC2,C39992603_decoy,WEE1,Decoy,0.0,-11.0408,-9.08,-2.28,-10.409323346876432
CC(C)(C)N1C(=O)[C@H]2[C@@H](c3ccc(/C=C/c4ccccc4)cc3)[NH2+][C@](C(=O)[O-])(c3ccccc3)[C@@H]2C1=O,C44173492_decoy,WEE1,Decoy,0.0,-9.02282,-7.51,-2.91,-6.453598879085486
CC[C@@H](C)c1ccc([C@@H](NC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c2cccs2)cc1,C45581458_decoy,WEE1,Decoy,0.0,-10.5436,-9.62,-1.37,-9.04988591078839
COc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)NCC45CC6CC(CC(C6)C4)C5)cc3N2)cc1,C12420623_decoy,WEE1,Decoy,0.0,-7.86407,-9.93,-4.51,-6.627269918794816
CC1(C)CN2C(N)=N[C@](c3ccc(OC(F)(F)F)cc3)(c3cccc(-c4cccnc4F)c3)C2=N1,C45254024_decoy,WEE1,Decoy,0.0,-5.93024,-6.08,-1.86,-4.478995727888618
C[C@@H]1CCc2c(sc(NC(=O)c3nn4c(c3Cl)N[C@@H](c3ccccc3)C[C@@H]4C(F)(F)F)c2C#N)C1,C08455851_decoy,WEE1,Decoy,0.0,-9.60376,-8.43,-3.02,-8.792489120169462
O=S(=O)(Nc1ccc(Cl)cc1Cl)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc3c(c1)OCO3)N2,C58847739_decoy,WEE1,Decoy,0.0,-10.6254,-9.8,-3.31,-9.804494439718132
CCCN(CCC)C(=O)C1=c2s/c(=C/c3ccccc3)c(=O)n2C(N)=C(C#N)[C@H]1c1ccccc1,C59293552_decoy,WEE1,Decoy,0.0,-9.02001,-8.5,-0.31,-10.184815472972362
CC(C)Oc1ccc(Br)cc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl,C14668001_decoy,WEE1,Decoy,0.0,-8.74174,-8.59,-4.05,-6.484761896842354
CCC(=O)N1c2ccccc2NC2=C(C(=O)C[C@@H](c3ccc([NH+](CC)CC)cc3)C2)[C@H]1c1ccco1,C08818345_decoy,WEE1,Decoy,0.0,-9.23192,-5.92,-2.23,-5.363731378163471
C[C@H]1CCc2c(sc(NC(=O)c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](c3ccc(Cl)cc3)N4)c2C#N)C1,C09489953_decoy,WEE1,Decoy,0.0,-10.0622,-9.46,-2.48,-6.833141784995602
Cc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1,C00070915_decoy,WEE1,Decoy,0.0,-7.72939,-5.42,-1.45,-3.7051048281160335
C[C@H]1CCC/C=C\[C@H]2C[C@H](O)C[C@@H]2[C@H](O)/C=C/C(=O)O1,C04545366_decoy,WEE1,Decoy,0.0,-7.7785,-4.91,-0.43,-2.818573782277732
NC(=O)/N=N/Cc1cc(Br)cs1,C05511062_decoy,WEE1,Decoy,0.0,-6.8753,-5.71,0.17,-6.333936389120884
c1ccc2c(c1)N[C@@H]([C@@H]1Nc3ccccc3O1)O2,C00135843_decoy,WEE1,Decoy,0.0,-6.16394,-9.06,-0.51,-12.620312464259747
C[C@H]1CCC/C=C\[C@@H]2C[C@H](O)C[C@H]2[C@H](O)/C=C/C(=O)O1,C13548530_decoy,WEE1,Decoy,0.0,-7.92173,-4.59,-0.65,-2.7975265125225754
Cc1cc(S(=O)(=O)N2CCCC2)ccc1N,C11755771_decoy,WEE1,Decoy,0.0,-6.69184,-6.78,-2.12,-6.661723791538524
C[C@@]12CCCC[C@]1(O)O[C@@]1(C)CCCC[C@@]1(O)O2,C17163798_decoy,WEE1,Decoy,0.0,-6.86445,-4.6,-1.99,-2.1970999778852547
Nc1ccc2nnc(/C=C/c3ccccc3)n2c1,C19753973_decoy,WEE1,Decoy,0.0,-6.94809,-8.32,0.47,-7.013475984149249
Cc1ccc(-c2c(C#N)c(N)nc3c2C[C@H](C)CC3)o1,C20479786_decoy,WEE1,Decoy,0.0,-7.44272,-8.88,-0.43,-6.2518042610022775
CC1(C)CC(=O)C2=C(C1)SC(N)=C(C#N)[C@H]2c1ccco1,C20654129_decoy,WEE1,Decoy,0.0,-8.47152,-4.41,-0.46,-3.3127430854638886
O=C([O-])c1ccc([C@H]2[NH2+]CCn3cccc32)cc1,C31889963_decoy,WEE1,Decoy,0.0,-7.2833,-4.27,-2.2,-3.2677779384002963
Nc1ccc2oc(N3CCc4ccccc4C3)nc2c1,C31978838_decoy,WEE1,Decoy,0.0,-7.37334,-8.57,-0.65,-6.179833586854622
Cc1c(N)ccc2nnc(-c3ccc(F)c(F)c3)n12,C36252660_decoy,WEE1,Decoy,0.0,-5.99418,-8.97,-0.65,-5.967310419949608
C[C@@H]1CCc2c(sc3nc(-c4ccncc4)c(N)n23)C1,C36290584_decoy,WEE1,Decoy,0.0,-8.62133,-8.44,-0.68,-6.151552158870197
C[C@@H](Cl)C(=O)NC(=O)NC1CCCCCC1,C36963124_decoy,WEE1,Decoy,0.0,-7.62077,-7.33,-1.49,-3.943071804543736
Cc1c(C)n(-c2ccc(F)c(F)c2F)c2ncnc(N)c12,C37353046_decoy,WEE1,Decoy,0.0,-7.54652,-9.6,0.49,-13.150255605812422
CC(C)c1noc(-c2cc(N)c(F)cc2F)n1,C37605745_decoy,WEE1,Decoy,0.0,-6.30574,-7.81,-0.23,-8.096394098375457
Nc1ccsc1-c1nc(C2CCCC2)no1,C37756535_decoy,WEE1,Decoy,0.0,-7.82324,-7.71,-1.07,-6.737047715782608
Cc1ccc2n1CCN(C(=O)c1cc(F)ccc1N)[C@@H]2C,C37798374_decoy,WEE1,Decoy,0.0,-6.29297,-5.5,-1.08,-3.597402242690756
N#Cc1c(N)nc2c(c1-c1ccco1)CCCCC2,C19594869_decoy,WEE1,Decoy,0.0,-7.46432,-9.51,-0.07,-10.696115515295883
Cc1nn(-c2c(F)c(F)c(F)c(F)c2F)c(N)c1C#N,C38537107_decoy,WEE1,Decoy,0.0,-7.07176,-9.11,0.37,-11.327976878128112
C[C@H]1CCN(C(=O)c2cc(N)cn2C)[C@H]2CCCC[C@H]12,C40325749_decoy,WEE1,Decoy,0.0,-7.19924,-4.53,-3.38,-3.5555543742258644
CC1CCC(C#N)(NC(=O)NC(C)(C)C)CC1,C40361645_decoy,WEE1,Decoy,0.0,-6.48797,-5.01,-3.84,-3.53834241779596
Nc1cnc(N2CC[C@H]3CCCC[C@@H]3C2)nc1,C40455824_decoy,WEE1,Decoy,0.0,-6.95286,-6.61,-0.9,-5.0489871069436685
Cc1cc(C)c(C(N)=S)c(-n2cccn2)n1,C40514908_decoy,WEE1,Decoy,0.0,-5.8228,-6.37,-0.66,-6.391567832165357
Cc1nn(-c2ccc(Br)cn2)c(C)c1N,C40516526_decoy,WEE1,Decoy,0.0,-6.32101,-6.36,-0.0,-4.8762753021197405
O=C(Nc1cccc2c1CCCN2)[C@H]1CCOC1,C40941904_decoy,WEE1,Decoy,0.0,-7.37913,-8.61,-2.17,-7.1556994187667815
CN(C(=O)[C@H]1C[C@H]2CC[C@@H]1C2)c1ccncc1N,C42174294_decoy,WEE1,Decoy,0.0,-5.87587,-7.48,-0.81,-8.122999117274095
C[C@@H]1CC[C@H](C(N)=O)CN1c1ccc(C#N)cc1,C42278265_decoy,WEE1,Decoy,0.0,-7.17427,-5.52,-1.16,-4.758425514253405
Nc1ccsc1C(=O)N1CCO[C@H]2CCC[C@H]21,C43423169_decoy,WEE1,Decoy,0.0,-7.16912,-7.37,-1.26,-6.676062423787879
Nc1ccc(N2CCO[C@@H]3CCCC[C@@H]32)cn1,C43424693_decoy,WEE1,Decoy,0.0,-7.19858,-8.4,-0.68,-9.7154929261293
N#Cc1cc(N)ccc1N1CCO[C@@H]2CCCC[C@@H]21,C43424803_decoy,WEE1,Decoy,0.0,-6.57372,-4.48,-1.8,-3.9555562727014446
Cc1c(C#N)c(N)n([C@H](C)c2ccncc2)c1C,C43531436_decoy,WEE1,Decoy,0.0,-6.75097,-4.01,-0.31,-3.2174698008211355
C[C@@H]1CCC/C=C/[C@@H]2C[C@H](O)C[C@@H]2[C@@H](O)/C=C/C(=O)O1,C44790296_decoy,WEE1,Decoy,0.0,-8.0078,-6.69,-1.57,-4.794619824888111
O=C(NC1CCC(O)CC1)N1C[C@H]2CC[C@@H]1C2,C48888664_decoy,WEE1,Decoy,0.0,-7.05789,-5.87,-2.12,-5.708565374964411
Cc1ccc([C@@H](C)n2c(C)c(C)c(C#N)c2N)o1,C49223815_decoy,WEE1,Decoy,0.0,-6.13002,-7.58,-1.1,-6.042151831671472
Nc1cc(C(=O)N2CCC[C@H]3CCCC[C@H]32)cc(Cl)n1,C50704036_decoy,WEE1,Decoy,0.0,-7.49723,-8.23,-1.3,-7.830006326167412
Nc1cccc(C(=O)N2CC[C@H]3CCCC[C@@H]3C2)n1,C51070949_decoy,WEE1,Decoy,0.0,-7.39412,-8.68,-2.0,-7.813347006647149
O=c1oc2ccccc2c([O-])c1[C@H]1[NH2+]CCc2ccccc21,C20218672_decoy,WEE1,Decoy,0.0,-7.1456,-9.93,-0.63,-13.51322528785558
Nc1ccc(-c2ccc3c(c2)OCCCO3)cn1,C52886385_decoy,WEE1,Decoy,0.0,-6.95975,-7.69,0.2,-6.253569117942761
O=C(Nc1ccc2c(c1)CCCN2)[C@H]1CCOC1,C54107659_decoy,WEE1,Decoy,0.0,-6.96072,-6.9,-0.96,-5.766909718280949
Nc1nc2cc(F)ccc2n1-c1ccc2ncccc2c1,C54108327_decoy,WEE1,Decoy,0.0,-7.37083,-10.37,0.3,-14.291730086274791
Cc1nc(-c2cc(Br)ccc2N)n(C)n1,C54499135_decoy,WEE1,Decoy,0.0,-6.1873,-7.51,-0.18,-5.714398758365169
Cc1nc(N)sc1C(=O)N1CCC[C@H](C)C1,C55170427_decoy,WEE1,Decoy,0.0,-7.06771,-7.4,-0.82,-7.105017932339969
C[C@@H]1CCc2c(sc3c2C(=O)N[S@@]([O-])=[NH+]3)C1,C57340685_decoy,WEE1,Decoy,0.0,-8.18566,-8.45,-0.37,-7.526041228982284
Cc1ncc(-c2nc3c(s2)CCCCC3)c(N)n1,C62329337_decoy,WEE1,Decoy,0.0,-7.57943,-6.98,-1.3,-5.368832388592786
Nc1ccc2c(c1)N(C(=O)c1cscn1)CCS2,C62353534_decoy,WEE1,Decoy,0.0,-6.8842,-3.99,-0.41,-4.084657675335096
C[C@@H]1Oc2c(cc(N)cc2C(C)(C)C)N(C)C1=O,C62535612_decoy,WEE1,Decoy,0.0,-6.87594,-7.93,-0.42,-7.428200243694499
OC1=Nc2n[nH]cc2[C@@H](c2ccc(F)cc2Cl)SC1,C20744943_decoy,WEE1,Decoy,0.0,-9.46051,-9.13,0.28,-7.98022124898554
OC1=Nc2n[nH]cc2[C@H](c2ccc(F)cc2Cl)SC1,C20744942_decoy,WEE1,Decoy,0.0,-8.75934,-7.7,-0.88,-7.64343052742703
COc1cc(C)c(C[NH+](C)CC(=O)Nc2sccc2C(N)=O)cc1OC,C07453286_decoy,WEE1,Decoy,0.0,-8.47773,-7.79,-2.62,-8.0448316520012
CC(=O)Nc1ccc(NC(=O)C[NH+](C)CC(=O)Nc2ccc(C)cc2)cc1,C07623541_decoy,WEE1,Decoy,0.0,-7.06017,-8.69,-2.82,-8.626382285656094
Cc1cc(C(=O)Nc2sc3c(c2C(N)=O)CC[NH+](C(C)C)C3)n(C)n1,C12229327_decoy,WEE1,Decoy,0.0,-9.22511,-7.45,0.2,-7.374469835285594
CCn1ncc(C[NH+](C)CC(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)c1C,C17082738_decoy,WEE1,Decoy,0.0,-8.49762,-8.45,-1.44,-11.786632458493711
COC[C@H](C)/[NH+]=C(\N)SCc1cc(=O)oc2cc(NC(C)=O)ccc12,C25864982_decoy,WEE1,Decoy,0.0,-7.88539,-7.87,-0.72,-9.333215120937968
CC(C)c1cc(C2=CCN(C(=O)[C@H]3[NH2+]CC4(CC4)C[C@@H]3C(=O)NO)CC2)ccc1C#N,C29037886_decoy,WEE1,Decoy,0.0,-9.09757,-10.1,-1.39,-7.399930670569274
Cc1ccc(C(O)(C(=O)NNC(=O)CN2CC[NH+](C)CC2)c2ccc(C)cc2)cc1,C19368109_decoy,WEE1,Decoy,0.0,-6.82216,-8.28,-4.33,-6.900310766310534
CCC[NH+]1CCc2c(sc(NC(=O)c3c(C)cnn3C)c2C(N)=O)C1,C38507141_decoy,WEE1,Decoy,0.0,-8.70236,-7.61,-0.32,-7.855182928169153
CCCCCCC(=O)N1C[C@H](C(=O)N[C@@H](C)C(=O)NC)C2(CC[NH2+]CC2)C1,C39683933_decoy,WEE1,Decoy,0.0,-8.29518,-6.88,-1.67,-4.970581486709499
CNC(=O)c1ccc(NC(=O)C(=O)NC[C@H](C)[NH+]2CCCC[C@H]2C)cc1,C41645280_decoy,WEE1,Decoy,0.0,-7.84323,-8.52,-3.27,-7.973955334789192
CCC(=O)Nc1ccc(NC(=O)C(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1,C41648054_decoy,WEE1,Decoy,0.0,-8.36988,-7.73,-3.45,-7.719925628246382
CCC(=O)Nc1ccc(NC(=O)C(=O)NC[C@@H](C)[NH+]2CCC[C@H](C)C2)cc1C,C41651160_decoy,WEE1,Decoy,0.0,-8.38767,-8.07,-2.81,-7.082374700664644
CNC(=O)c1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c1,C42642605_decoy,WEE1,Decoy,0.0,-7.59932,-7.96,-0.86,-7.70728701571576
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC12CC[NH2+]CC2,C44714171_decoy,WEE1,Decoy,0.0,-8.15495,-5.56,-1.43,-5.335707572317792
CC(C)[C@@H](CNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)[NH+]1CCCCCC1,C45534277_decoy,WEE1,Decoy,0.0,-8.37637,-6.88,-2.56,-7.007637999063168
C[C@@H]1CCCC[NH+]1CCCCNC(=O)NN[C@]1(C)CCS(=O)(=O)C1,C46751138_decoy,WEE1,Decoy,0.0,-7.70299,-6.71,-2.4,-6.709938410629049
NC(=O)CC1CC[NH+](CC(=O)NCC2(N3CCOCC3)CCCCC2)CC1,C48025355_decoy,WEE1,Decoy,0.0,-8.75169,-7.69,-1.61,-7.148702749204848
CNC(=O)c1ccc(NC(=O)C(=O)NC[C@@H](c2cccs2)[NH+](C)C)c(C)c1,C48743648_decoy,WEE1,Decoy,0.0,-9.54656,-8.18,-1.67,-8.41167787923188
C[NH+](C)C1(CNC(=O)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)CCCC1,C48752580_decoy,WEE1,Decoy,0.0,-8.5435,-8.15,-1.1,-7.951186838851444
NS(=O)(=O)c1ccc(NC(=O)CN2CC[NH+](CC3CCCCC3)CC2)cc1,C49981851_decoy,WEE1,Decoy,0.0,-8.67157,-8.12,-2.99,-7.048465667802907
CCC[C@H](C)NC(=O)[C@H]1CCC[NH+]([C@@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)C1,C51051786_decoy,WEE1,Decoy,0.0,-8.73489,-6.05,-3.87,-3.9092342365788624
CC(C)NC(=O)NC(=O)[C@H](C)[NH+]1CCC(C(=O)NCc2ccc(F)cc2)CC1,C53049673_decoy,WEE1,Decoy,0.0,-7.29232,-4.4,-1.6,-3.976763016374025
COc1ccc([C@@H]2CCC[NH+]2CC(=O)Nc2sccc2C(N)=O)c(OC)c1,C07739930_decoy,WEE1,Decoy,0.0,-8.42371,-7.19,-2.4,-7.70881389793802
CCCNC(=O)C[NH+]1CCC(NC(=O)C2(NC(C)=O)CCCCC2)CC1,C58131059_decoy,WEE1,Decoy,0.0,-8.5256,-7.52,-3.99,-7.243321438044485
COc1ccc(S(N)(=O)=O)cc1C(=O)N[C@H](C)C[NH+]1C[C@H](C)C[C@@H](C)C1,C55748786_decoy,WEE1,Decoy,0.0,-9.74994,-7.79,-5.62,-6.196295229681389
N#Cc1ccc(C(=O)NNC(=O)NCC2([NH+]3CCSCC3)CCCC2)cc1,C61865226_decoy,WEE1,Decoy,0.0,-7.79308,-8.89,-2.57,-10.808322200181388
CS(=O)(=O)N[C@@H]1Nc2ccc(C(=O)NCCC3=c4ccccc4=[NH+]C3)cc2S1,C63280856_decoy,WEE1,Decoy,0.0,-9.56699,-10.23,-0.78,-9.092661938181442
CC(C)(C)NC(=O)NC(=O)C[NH+]1CCC(C(=O)NCCc2cccs2)CC1,C63301860_decoy,WEE1,Decoy,0.0,-9.49156,-7.7,-4.43,-5.783604525833147
CC(C)NC(=O)c1ccc(NC(=O)C(=O)NC2CC[NH+](CC(F)F)CC2)cc1,C64303998_decoy,WEE1,Decoy,0.0,-7.25861,-7.68,-0.71,-6.819886665741398
C[C@H]1CCCC[C@H]1NC(=O)NC(=O)C[NH+]1CCC[C@@H](C(=O)NC2CC2)C1,C65251820_decoy,WEE1,Decoy,0.0,-8.60763,-7.13,-3.93,-6.609956012354513
CC1CC[NH+]([C@H](C)CNC(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)CC1,C65359919_decoy,WEE1,Decoy,0.0,-8.92337,-9.02,-3.5,-8.389786591646747
COCCN1C[C@H](CNc2nc(CC[NH3+])nc3sc(C)c(C)c23)CC1=O,C65380893_decoy,WEE1,Decoy,0.0,-8.44778,-7.38,-2.45,-7.930893307181348
CNS(=O)(=O)c1ccc(CNC(=O)NC[C@H](C)[NH+]2CCC(C)CC2)s1,C65477296_decoy,WEE1,Decoy,0.0,-9.60953,-7.77,-2.04,-9.58412617246037
CC[NH+](CC)[C@H](CNC(=O)NNC(=O)c1ccc(F)cc1)c1ccco1,C65481335_decoy,WEE1,Decoy,0.0,-7.41214,-7.11,-1.42,-7.122582091049392
CNC(=O)c1ccc(NC(=O)C(=O)NC[C@@H](c2ccc(C)cc2)[NH+](C)C)c(C)c1,C65601173_decoy,WEE1,Decoy,0.0,-7.22961,-8.54,-3.81,-7.012597227917905
CNC(=O)Cc1ccccc1NC(=O)C(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C,C65601176_decoy,WEE1,Decoy,0.0,-8.22546,-8.45,-4.14,-8.959527426512892
C=CCNC(=O)c1ccc(NC(=O)C(=O)NC[C@H](C)[NH+]2CCC(C)CC2)cc1,C65601422_decoy,WEE1,Decoy,0.0,-8.29685,-8.37,-0.28,-7.607530599712211
CCCC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H]2CC[NH+](C(C)C)C2)c1,C65638345_decoy,WEE1,Decoy,0.0,-8.3642,-8.05,-3.44,-7.49106290339987
C=CCNC(=O)c1ccc(NC(=O)C(=O)NC[C@@H]2CC[NH+](C(C)C)C2)cc1,C65638441_decoy,WEE1,Decoy,0.0,-7.57005,-7.46,-2.19,-6.806887529562446
CNC(=O)c1ccc(C)c(NC(=O)C(=O)NC[C@H]2CC[NH+](C(C)C)C2)c1,C65639235_decoy,WEE1,Decoy,0.0,-6.95023,-7.93,-1.81,-11.095953642857385
NC(=O)CC[C@H]1CCCN(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)C1,C66118970_decoy,WEE1,Decoy,0.0,-7.90607,-5.04,-2.13,-5.125795495628143
CN(C)c1cc(CNC(=O)NCc2ccc(C(=O)NC3CC3)cc2)cc[nH+]1,C66359219_decoy,WEE1,Decoy,0.0,-8.26003,-7.79,-1.28,-6.32450229489052
COCCNC(=O)NC(=O)[C@@H](C)[NH2+]CC1(c2ccc(F)cc2)CCOCC1,C66390439_decoy,WEE1,Decoy,0.0,-7.90502,-6.35,-3.68,-4.597654072152828
O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]12)NCCc1cn2c([nH+]1)CCCC2,C67160900_decoy,WEE1,Decoy,0.0,-9.47728,-8.18,-1.44,-11.06442162183326
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NC2CC[NH+](CC(C)C)CC2)c1,C67265316_decoy,WEE1,Decoy,0.0,-8.26497,-6.76,-5.12,-8.28570960304528
CC(C)CCC(=O)NNC(=O)NCc1ccccc1CN1CC[NH+](C)CC1,C67388809_decoy,WEE1,Decoy,0.0,-8.07665,-8.26,-4.26,-7.333672017223905
CCC[NH+]1CC[C@@H](CNC(=O)C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)C1,C67393139_decoy,WEE1,Decoy,0.0,-7.87266,-7.82,-2.45,-7.100863614226288
CC(=O)NC[C@H]1CCC[NH+]([C@@H](C)C(=O)NC(=O)Nc2ccc(C)cc2)C1,C67413689_decoy,WEE1,Decoy,0.0,-7.27543,-7.69,-2.83,-4.745103139117404
CC(=O)Nc1ccc(C)c(NC(=O)C(=O)N[C@@H](C)C[NH+]2C[C@H](C)C[C@H](C)C2)c1,C67438541_decoy,WEE1,Decoy,0.0,-8.69702,-9.36,-3.04,-9.086983697457349
CS(=O)(=O)N1CCC[C@@H](NC(=O)NCCC[NH2+]C2CCCCC2)C1,C67625565_decoy,WEE1,Decoy,0.0,-8.24923,-7.56,-1.73,-10.249744375728142
,C21045928_decoy1,,,,-7.99021,-9.11,,-7.916378033215971
,C21045928_decoy2,,,,-7.34544,-8.33,,-6.757416206017608