p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
COc1ccccc1-n1c(C)cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)c1C | COc1ccc(CC(=O)Nc2ccc(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)cc2)cc1OC | 0.564901 |
C[C@@H]1Cc2cc(C(=O)Nc3ccc(Br)cc3)ccc2N1S(=O)(=O)c1ccccc1 | COc1ccc(CCC(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)cc1 | 0.549311 |
O=C(N[C@@H](CSCc1ccccc1)C(=O)NN=C1CCCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 | COc1ccc(F)cc1C(=O)N1Cc2ccccc2C[C@@H]1C | 0.509456 |
CCN1C[C@H](CN(C)C(=O)c2ccc(Cl)cc2N2CCCC2=O)Oc2ccccc21 | Cc1cc(C)c2c(n1)CC(C)(C)CC2=O | 0.504329 |
COC(=O)C1=C(CS(=O)(=O)c2ccc3c(c2)CCCC3)NC(=O)N[C@@H]1c1ccc(O)c(OC)c1 | Clc1ccc(-c2nc(N3CCOCC3)ncc2-c2ncc[nH]2)cc1 | 0.550916 |
COc1c(C(=O)OCc2nnc(-c3ccc(C#N)cc3)o2)oc2ccccc12 | C=CCN(c1cc(Cl)ccc1OC)S(=O)(=O)c1ccc(Br)cc1 | 0.561441 |
O=C(Cc1csc(NC(=O)c2ccc3c(c2)OCO3)n1)Nc1cccc(F)c1 | O=C(O)C[C@H]1COCCN1C(=O)c1cc2ccccc2s1 | 0.510591 |
CCc1ccc(CN(C)C(=O)Cn2cnc3cc(F)ccc3c2=O)cc1 | CS(=O)(=O)N1CCn2nc(CNC(=O)c3cnc4c(c3)CCC4)cc2C1 | 0.594017 |
CNC[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F | C=CCN1C(=O)[C@@]2(C(C(=O)c3ccc4c(c3)C[C@@H](C)O4)=C(O)C(=O)N2CCN(C)C)c2ccccc21 | 0.619235 |
CCCC[N+]1=C2[C@H](OC(=O)c3ccccc3)CCN2Cc2ccccc21 | C[C@@](O)(CNC(=O)NCc1ccc(Cl)cc1)c1ccc2c(c1)OCO2 | 0.51027 |
COCCN(C)C(=O)c1cnn(-c2ncc3c(n2)-c2cc(OC)ccc2CC3)c1C1CC1 | Cn1c(=O)oc2cc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)ccc21 | 0.638554 |
Cc1nc(-c2cccs2)sc1CNC(=O)[C@@H]1CC(=O)N(c2cccc(F)c2)C1 | O=C(Cc1cccs1)N1C[C@H]2C[C@@]3(CCCNC3=O)[C@@H](C1)O2 | 0.568085 |
C=CCOc1ccccc1[C@H]1NC(=S)NC(C)=C1C(=O)Nc1ccc(C)cc1C | CC(C)c1cc([C@@H]2CCCN(C(=O)N[C@@H]3CCN[C@H]3C)C2)n[nH]1 | 0.518558 |
Cc1cc(-n2cnnc2)cc2nc(-c3ccc(Cl)c(Cl)c3)oc12 | Cc1oc(-c2ccccc2)nc1Cc1cc2cc(N)ccc2o1 | 0.599781 |
Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)Nc1cccc(C(N)=O)c1 | O=C(NCC(=O)N1CCN(c2ccccn2)CC1)c1ccc(Cl)c(Cl)c1 | 0.500551 |
CCN(C(=O)c1ccnc(-c2ccccc2)c1N)[C@@H]1CCOC(C)(C)C1 | CC(C)(C)OC(=O)NC1(CNC(=O)c2cccc(-n3cnnn3)c2)CCCCCC1 | 0.527936 |
COc1ccc(C(=O)C2=C(O)C(=O)N(CCCN3CCOCC3)[C@H]2c2ccccc2)cc1OC | CCO[C@H]1CN(C)C[C@@H]1NC(=O)c1ccccc1N1CCOCC1 | 0.589852 |
O=C(Nc1ccc2c(c1)CCC2)c1ccn(COc2ccc(Br)cc2)n1 | COc1ccccc1-c1nccnc1[C@H]1CCCN(CC(=O)N(C)C)C1 | 0.523128 |
C[C@H]1[C@H](C(=O)N(C=O)c2ccccc2F)[C@H]2C=C[C@H]1C21CC1 | CC(C)NC(=O)c1ccnc(N2CCC[C@@](CO)(Cc3ccccc3F)C2)c1 | 0.508813 |
Cc1ccc(S(=O)(=O)c2nc(-c3ccco3)oc2NC2CC2)cc1 | Cc1nc(SCC(=O)NCc2ccc(Cl)cc2)n(C2CC2)c1C | 0.536998 |
O=c1cc(CN2CCC[C@H]2Cn2cccn2)nc2ccc(Cl)cn12 | O=C(c1c[nH]nc1[C@@H]1CCOC1)N1CCC2(CCC(O)CC2)CC1 | 0.552719 |
CN1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])c2nc3ccccc3nc21 | Cc1cc(C)c(C)c(CN2C(=O)C[C@@H](C)Nc3ccccc32)c1C | 0.530837 |
Cc1ccc2c(C(=O)N3C[C@@H]4CCC[C@@]4(C(N)=O)C3)cnn2c1C | O=C(CCc1cccnc1)NC[C@]1(O)CCCN(c2ccc(F)cn2)C1 | 0.567213 |
CCc1ccc(NC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)cc1 | COc1ccccc1NC(=O)c1cc2cnn(C(C)C)c2nc1C | 0.592357 |
Cc1nc(CCNC(=O)N[C@@H]2CCCc3c2cnn3CCO)cs1 | COc1cc(N2CCOCC2)ccc1CN1CCC([C@@]2(C)CCCCN(C)C2=O)CC1 | 0.507726 |
COc1ccc(N2C(=O)/C(=C/c3ccco3)NC2=S)cc1 | Cc1ccc(N(CC(=O)Nc2ccccc2C(N)=O)S(C)(=O)=O)cc1Cl | 0.509455 |
Cc1nc([C@H](C)N(C)S(=O)(=O)c2cc(C(=O)O)ccc2Cl)c(C)s1 | Cc1ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc4ccccc34)C2)cc1C | 0.547312 |
COc1ccc(-c2nc(CN3CCCC[C@H]3c3ccccn3)c(C)o2)c(OC)c1 | COc1ccc2cc1OCC(=O)NCc1ccc(cc1)O[C@@H]1CCN(C(=O)C(C)C)C[C@@H]1NC2=O | 0.598517 |
CN(C)S(=O)(=O)c1ccccc1CNC(=O)c1cncn1-c1ccccc1 | Cn1cccc1[C@H]1COCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 | 0.559867 |
COc1cccc([C@H]2C(C(=O)c3ccc(OC)c(OC)c3)=C(O)C(=O)N2c2cc(C)on2)c1 | C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)N1C(=O)c1ccccc1Br | 0.654965 |
Cc1cc([C@@H]2CCCN2S(=O)(=O)c2cn3c(n2)CCCC3)no1 | COCCN(C(=O)[C@@H]1CCCO[C@@H]1C)c1nc2ccccc2s1 | 0.661585 |
Cc1cccc(C)c1OCCSc1nc(N)c(C#N)cc1C#N | Cc1cnc(CCNC(=O)[C@H]2C[C@]23CCOc2ccccc23)s1 | 0.534937 |
COC(=O)c1c(NC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c(C#N)cn1C | CCOc1ccc([C@H](C)NC(=O)c2ccc3c(O)[nH]c(=S)nc3c2)cc1 | 0.550429 |
CCOc1ccc2nc(N3CCC(C(=O)NCc4ccccc4OC)CC3)nc(C)c2c1 | Cc1cccc(-c2nnc(SCc3c(F)c(F)c(F)c(F)c3F)n2C)c1 | 0.50055 |
CNC(=O)[C@@H]1CN(C(=O)c2ccccc2F)c2ccccc2O1 | CCCN1Cc2nnc(-c3cccc(C)c3)n2[C@@H](C)C1=O | 0.635135 |
CCOc1ccc(CN2CCc3[nH]cnc3[C@H]2CC)cc1CO | CCCn1c(=O)c2c(nc3n2[C@@H](C)C(C)=NN3CC(=O)OCC)n(C)c1=O | 0.643 |
Cc1c(C(=O)N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)nnn1-c1cccc2ncccc12 | COC(=O)C1=C(N)OC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1cccs1 | 0.75223 |
CCOC(=O)COCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O | COc1ccc(C)cc1NC(=O)CSc1nc2c(sc(=S)n2-c2ccc(C)cc2)c(=O)n1C | 0.638362 |
Cc1cccc([C@H]2CCCN2C(=O)Nc2cnn(CC(F)F)c2)c1C | CC(C)OCCCN1C(=O)C(O)=C(C(=O)c2ccc(Br)cc2)[C@@H]1c1ccc(O)cc1 | 0.627244 |
Cc1cc(C)c2cc(CN(CCN(C)C)C(=S)N[C@H](C)c3ccccc3)c(=O)[nH]c2c1 | Cc1noc([C@@H]2CN(C(=O)c3cnc4cnccc4c3)CCN2C)n1 | 0.61748 |
CC(C)CN1C(=O)NC(=O)[C@]2(Cc3c(nc4ccccn4c3=O)N3CCCCC[C@@H]32)C1=O | Cc1ccc2nc(CNC(=O)[C@@H]3CSC(C)(C)C(=O)N3)[nH]c2c1C | 0.624874 |
O=C(COC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1ccc2c(c1)CCC2 | COc1ccc([C@H]2c3c(oc4ccccc4c3=O)C(=O)N2CCCN(C)C)cc1OC | 0.600616 |
COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H]1CN(S(C)(=O)=O)c2cc(Cl)ccc2O1 | O=C1C(=O)N(C[C@H]2CCCO2)[C@@H](c2cccc(F)c2)/C1=C(\O)c1ccccc1 | 0.746283 |
COc1ccccc1Cn1c(=O)c2cccnc2n(Cc2ccc(F)cc2)c1=O | Cc1cc(C)c(CNC(=O)N[C@H](C)[C@@H]2C[C@@H]2c2ccccc2)c(=O)[nH]1 | 0.523344 |
C=CCn1c(C)cc(C(=O)COC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)c1C | Cc1cccc(-n2ccnc2S[C@H](C)C(=O)N(C)Cc2cccc(F)c2)c1 | 0.556745 |
O=C(Nc1ccc(-c2nnc3n2CCCCC3)cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 | C=CCSc1nnc(NC(=O)C2=NN(c3ccccc3)[C@H](c3ccccc3)C2)s1 | 0.697746 |
Cc1ccc(C(=O)OCC(=O)Nc2ccc(F)cc2F)cc1S(=O)(=O)N1CCCCC1 | Cc1cnn(C)c1S(=O)(=O)N1CCC[C@H](N(C)C)CC1 | 0.560185 |
O=C(Nc1c(-c2ccc(F)cc2)nc2ccccn12)c1cc(O)ncn1 | COC(=O)c1ccc(OC[C@H](O)C[n+]2c(C)n(C)c3ccccc32)cc1 | 0.55235 |
Cc1ccc(NCCCNc2ncnc3c2cnn3CCO)nc1 | Cc1ccc(S(=O)(=O)N2C[C@@H](O)C[C@@H]2C(=O)OCc2cc(-c3ccccc3)on2)cc1C | 0.566946 |
CN(C)/C=N/c1c(C#N)nnc2ccnn12 | COc1ccc(Cl)cc1NC(=O)Cn1c(=O)n(Cc2ccc(C)c(C)c2)c(=O)c2sccc21 | 0.592145 |
Cc1nc([C@H](Cc2ccsc2)NC(=O)c2ccnn2C)sc1C | Cc1cc(NC(=O)COC(=O)[C@H](C)NC(=O)c2ccccc2Cl)no1 | 0.515385 |
CN1C(=O)C(=Cc2cn(CC(=O)Nc3ccccc3)c3ccccc23)C(=O)N(C)C1=S | Cc1nn(-c2ccc(C(=O)N3CC[C@@H](C(=O)O)C3)cc2)c(C)c1Br | 0.552716 |
N[C@@H]1C[C@H](NS(=O)(=O)c2cccc3c2OCCCO3)C12CCC2 | COc1ccc(OC)c2nc(N(C)C)c(CN(Cc3ccco3)C(=O)c3ccc4c(c3)OCO4)cc12 | 0.592476 |
CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N2C[C@@H](C)O[C@H](C)C2)C1=O | Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)N1CCN(Cc2ccc3c(c2)OCO3)CC1 | 0.550647 |
CC(=O)N1CCC[C@@H]1c1nc(C)cc(N2CCC(C)CC2)n1 | Cc1ccc(C2=NN(C(=O)CN3C[C@H](C(N)=O)Oc4ccccc43)[C@H](c3ccco3)C2)cc1 | 0.61722 |
COc1cc(/C=N\Nc2nnn[nH]2)c([N+](=O)[O-])cc1OC | COc1ccc(/C(C)=N/OCC(=O)Nc2nc3ccccc3s2)cc1OC | 0.515375 |
C[C@@]12CN(C(=O)C3c4ccccc4Oc4ccccc43)C[C@@]1(C)C(=O)NC2=O | CN(C)C(=O)C[C@@]1(O)CCCN(c2nc(C(F)(F)F)ccc2C#N)C1 | 0.575192 |
Cc1ccc(NC(=O)Cn2c(=O)n(-c3cccc(C)c3C)c(=O)c3sccc32)c(Br)c1 | COc1ccccc1[C@H]1[C@H](C(=O)NCC2CCOCC2)SCC(=O)N1C1CCCCC1 | 0.767627 |
O=C1/C(=C/c2ccccc2)Oc2c1ccc1c2CN(Cc2ccco2)CO1 | CCN(CCNC(=O)[C@H](CC(C)C)OC)C(=O)c1cnc(C)n1C | 0.509014 |
O=C(C1=C(O)C(=O)N(CCCn2ccnc2)[C@@H]1c1cccc(Br)c1)c1ccccc1 | CCN(CC)c1ccc(NC(=O)CSc2nnc(-c3ccccc3)n2N)cc1 | 0.549738 |
CCn1c(SCC(=O)N(C)C2CCCCC2)nnc1[C@@H](C)NC(=O)Cc1ccc(OC)cc1 | C=CCOc1ccc(C=Nn2c(C(C)(C)C)nc3ccc(Br)cc3c2=O)cc1[N+](=O)[O-] | 0.649528 |
Cc1ccc(-c2noc(CN3CCN(S(=O)(=O)c4c(Cl)cccc4Cl)CC3)n2)cc1 | Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCCCNc1ccc(C(F)(F)F)cn1 | 0.550054 |
C[C@@]1(c2cccc3ccccc23)NC(=O)N(CC(=O)Nc2sc3c(c2C#N)CCCCC3)C1=O | CN(c1ncccc1CNC(=O)[C@H]1CCCCN1C)C1CCCCC1 | 0.594678 |
CC(=O)Nc1ccc(NC(=O)[C@@H](C)OC(=O)[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)C(C)C)cc1 | Nc1nnc([C@@H](NC(=O)C2(c3ccc(F)cc3)CC2)c2ccccc2)s1 | 0.507795 |
O=C(N[C@H](c1ccccc1)c1cccnc1)[C@@H]1C[C@@H]1c1ccccc1 | Cc1ccc(C(=O)Cn2cccc3c(=O)n(Cc4ccccn4)c(=O)nc2-3)cc1C | 0.504228 |
OC[C@@]1(CCOc2ccccc2)CCCN(Cc2cc3c(cc2Cl)OCO3)C1 | Cc1cc(O[C@@H](C)C(=O)NCc2cccnc2)c2c3c(c(=O)oc2c1)CCC3 | 0.565832 |
COC[C@@H]1CCS(=O)(=O)C12CN(C(=O)c1ccc3c(c1)OCO3)C2 | Cc1c([C@@H](C)NC2CCN(Cc3cccnc3)CC2)cnn1-c1ccccc1 | 0.528587 |
Cc1ccnc(-c2noc(COC(=O)CCC(=O)c3ccc(Br)cc3)n2)c1 | Cc1ccc(Cl)cc1NC(=O)Cn1c(=O)n(C)c(=O)c2ccccc21 | 0.561213 |
Cc1c([C@@H]2CCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)n2c(nc1=O)CCC2 | O=C(c1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1)N(CCO)c1ccccc1 | 0.70522 |
CCn1nc(C)c([N+](=O)[O-])c1C(=O)N1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 | C[C@@H]1CCCN(CCCNC(=O)[C@@H]2CC(c3ccc(Cl)s3)=NO2)C1 | 0.539615 |
COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1 | O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1Cl)[C@@]1(C(=O)Nc3ccc(Cl)cc31)N1CCC[C@@H]21 | 0.665347 |
O=C1[C@H]2CCCN2C(=O)N1C1CCN(Cc2ccccn2)CC1 | CCOc1cc(/C=N\c2c(C)n(C)n(-c3ccccc3)c2=O)cc(Cl)c1O | 0.526092 |
COc1ccc(NC(=O)CSc2nc3ccsc3c(=O)n2-c2cc(C)ccc2C)cc1OC | COc1cccc(OC)c1C(=O)NC(=S)Nc1cccc([N+](=O)[O-])c1C | 0.599372 |
CCC(=O)N1CCN(S(=O)(=O)c2ccc(CC(C)C)cc2)CC1 | Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3OCc3c(C)noc3C)CC2)cc1 | 0.551546 |
C[C@H](Oc1ccc2c(C(F)(F)F)cc(=O)oc2c1)C(=O)NCc1ccc2c(c1)OCO2 | COc1cc(OC)c(C2=CCN(S(=O)(=O)c3ccc(C)s3)CC2)c(OC)c1 | 0.570362 |
O=C(CN1C(=O)c2cccc3cccc1c23)NCCSC1CCCC1 | CC(=O)c1ccc(N2CCN(C(=O)Cn3nc(C)c([N+](=O)[O-])c3C)CC2)c(F)c1 | 0.571744 |
COc1ccc2c(Cl)c(C(=O)NCc3ccco3)sc2c1 | COc1ccccc1[C@@H](NC(=O)NCCc1cccc(Cl)c1)c1nccn1C | 0.531844 |
COc1ccc(CN2CCC(c3nc4ccc(N5CCOCC5)cn4n3)CC2)cc1 | COCCCNS(=O)(=O)c1ccc(NCc2ccco2)c(C(=O)O)c1 | 0.524499 |
Cn1nc(C(F)(F)F)cc1C(=O)Nc1ccc(-n2cccn2)cc1 | CCCC[C@H]1Oc2ccc(S(=O)(=O)N3CCCCC3)cc2NC1=O | 0.517897 |
Cc1cc(=O)n(-c2c(C)cccc2Cl)c(/C=C(\O)c2ccncc2)n1 | COc1ccc2c(c1)CCCN(C(=O)CC1(O)CCCC1)C2 | 0.504907 |
C[C@@H]1CCCC[C@H]1NC(=O)c1cc2cccnc2n(Cc2ccccc2)c1=O | COc1ccc(CCC(=O)N2CC[C@@H](c3c(C(=O)N(C)C)sc4ncccc34)C2)cc1 | 0.703141 |
Cc1cc(Br)c2oc(Cc3ccccc3)nc2c1 | COC(=O)[C@H]1C[C@H]2CN(C(=O)C3(CO)CC3)CC(=O)N2[C@H]1c1ccccc1 | 0.507543 |
COc1ccc(-n2c(SCC(=O)c3ccccc3)nc3c(c2=O)S[C@@H](C)C3)cc1 | CC(=O)N1CC2(CCN(C(=O)c3cccnc3)CC2)C[C@H](O)C1(C)C | 0.522326 |
COc1cccc([C@@H]2CCCN2C(=O)c2ccnc(-n3ccnc3)c2)c1 | O=C(c1cc(F)c(F)c(O)c1F)N1CC[C@@H](c2ccc(F)cc2)C1 | 0.594152 |
CC(C)c1cc(C(=O)NCC2CCN(c3cc4nncn4c(N)n3)CC2)on1 | COc1ccc(NC(=O)CSc2nnc(Nc3ccccc3C)s2)c(OC)c1 | 0.529221 |
O=C([C@@H]1COc2ccccc2O1)N1CCC(c2nc3ccccc3s2)CC1 | O=C(Nc1cccc(C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)c1)NC1CC1 | 0.58836 |
Cc1ccccc1NC(=O)[C@H]1CC(=O)Nc2nc(N3CCC(C)CC3)[nH]c(=O)c21 | COc1cccc(-c2nnsc2C(=O)Nc2c(C)cccc2C)c1 | 0.634172 |
COc1cccc([C@H]2c3c(oc4cc(C)c(C)cc4c3=O)C(=O)N2c2ccc(C)cn2)c1 | CS(=O)(=O)Nc1ccc(C2=NN(C(=O)c3cccs3)[C@H](c3ccc(F)c(Cl)c3)C2)cc1 | 0.77998 |
O=C(O)c1c(C(F)(F)F)ccc(Br)c1O | CCC(=O)N(Cc1ccc(C)cc1)[C@H](C)C(=O)NC | 0.29037 |
Cc1noc(C)c1CC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1O | NC(=O)C1CCN(c2nc3c(S(=O)(=O)c4ccc(Cl)cc4)nnn3c3ccsc23)CC1 | 0.625378 |
Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1C(=O)NC1([C@@H](C)O)CC1 | Cc1ccc(C)c(NC(=O)c2nc(-c3ccccc3)n(-c3ccc(F)cc3)n2)c1 | 0.559524 |
CCOc1ccccc1[C@@H]1[C@H](C)N[C@]2(C(=O)Nc3ccccc32)[C@H]1[N+](=O)[O-] | COC(=O)c1ccc(NC(=O)[C@H](C)NC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 | 0.516717 |
C[C@H](C(=O)Nc1cc(F)ccc1F)S(=O)(=O)c1cc(F)ccc1F | Cc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@@H](C(=O)C(C)(C)C)N2c4ccccc4C=C[C@@H]32)cc1 | 0.576289 |
C=CCN1C(=O)N/C(=C/c2ccc(OCc3ccccc3)c(OC)c2)C1=O | COC1=CC=C/C(=C/C=C2\Oc3c(cccc3OC)C=C2C(C)=O)C1=O | 0.557503 |
CC[C@H](C)N1CC(=O)C(c2nc(C)cs2)=C1N | O=C(O)[C@@H]1CCCN(C(=O)c2cccn2CCc2ccccc2)C1 | 0.517978 |
Cc1ccc(-c2cc3cccnc3n2CCC(=O)O)cn1 | CCc1nc2sc([C@H](c3ccc(C(F)(F)F)cc3)N3CCN(c4ccccc4)CC3)c(O)n2n1 | 0.665984 |
C[C@H](NC(=O)CSc1nnc(-c2ccc3c(c2)OCCCO3)n1C)c1ccccc1 | O=C(CN1c2cccc3cccc(c23)S1(=O)=O)Nc1ccccc1Oc1ccccc1 | 0.597701 |
CN(CC1CCCC1)C(=O)c1cccc(N2CCCS2(=O)=O)c1 | Cc1nc(C(F)(F)F)ccc1C(=O)N1CCC(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1 | 0.570093 |
CC(O)=Nc1ccn([C@@H]2CCN(C(=O)[C@@]3(C)CCCO3)C2)n1 | O=C(C[C@H]1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)N(Cc2cccs2)C2CC2)c1 | 0.595264 |
COCCNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F | CCc1nc(N2CCC[C@H](C(N)=O)C2)c2nnn(Cc3ccccc3Cl)c2n1 | 0.61689 |
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