p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
O=C(NCc1ccco1)c1nc(O)c2nnn(Cc3ccccc3Cl)c2n1 | CCc1ccc(C(=O)N(CCO)Cc2[nH]cnc2C)s1 | 0.536138 |
Cc1cc(C)cc(NC(=O)C(=O)NC[C@H](c2ccc3c(c2)CCCN3C)N2CCOCC2)c1 | CCN1CCO[C@@H](C(=O)NCc2ccccc2N2CCN(C)CC2)C1 | 0.554994 |
Cc1nn(C(F)F)c(C)c1CC(=O)N1CCCc2cc(Cl)ccc21 | CCN(C(=O)[C@@H](C)OC(=O)c1c[nH]c(C)c(Cl)c1=O)[C@@H]1CCS(=O)(=O)C1 | 0.624866 |
Cn1cc(CC(=O)NC2CCN([C@H]3CCS(=O)(=O)C3)CC2)c2ccccc21 | CCc1nnc2sc(-c3cccc(NS(=O)(=O)c4ccccc4)c3)nn12 | 0.527056 |
CCc1nn(C)cc1/C(O)=N/C[C@H]1CCn2ccnc2C1 | Cc1nn(C)c2c1[C@@H](c1cccc(OC3CCCC3)c1)CC(=O)N2 | 0.603393 |
CC(=O)NC[C@]1(c2ccccc2)CC[C@@H](O)[C@H](N(C)C(=O)c2ccccc2C)CC1 | O=C(CN1C(=O)NC(Cc2ccccc2)(Cc2ccccc2)C1=O)Nc1ccc2c(c1)OCCO2 | 0.566265 |
CC[C@@H](C(=O)NCC1(c2ccccc2)CCOCC1)N(c1ccc(Cl)c(Cl)c1)S(C)(=O)=O | COc1ccc2c(c1)CCC[C@]2(O)CNC(=O)C1(c2ccccc2)CCOCC1 | 0.635667 |
CCS(=O)(=O)[C@H]1[C@@H](c2cccc(F)c2)[C@@]1(CN)C(=O)O | COc1ccc(C)cc1-n1c(SCC(=O)O)nnc1[C@H]1CCCN(C)C1 | 0.680328 |
NC(=O)COc1ccc(/C=C2\SC(=Nc3ccccc3)N(C[C@@H]3CCCO3)C2=O)cc1 | N#Cc1nc(/C=C/c2cccs2)oc1NCCCN1CCOCC1 | 0.522222 |
Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@@H]1CCCc2c1cnn2C | COc1cc(C(=O)N2C[C@@H](F)C[C@H]2CO)ccc1OC1CCCC1 | 0.572038 |
COc1ccc(C(=O)O[C@@H](C)C(=O)N2CCC(C)CC2)cc1S(=O)(=O)NC1CC1 | O=C1O[C@@H](CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c2ccccc21 | 0.548206 |
CCc1ccccc1NC(=O)Cn1c(-c2ccc(Cl)cc2)nc(C)c(CCO)c1=O | COc1ccc(CN2CCNC(=O)[C@H]2CC(=O)N2CCC(O)CC2)c(OC)c1 | 0.540254 |
CC(C)C(=O)N1CCO[C@@H](c2nc(N(C)C)ncc2-c2cccc(C(N)=O)c2)C1 | CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)c1sc2cc(Cl)ccc2c1Cl | 0.612735 |
C=CCC(C)(C)c1nccn1-c1ccc2c(c1)nc([C@H](C)O)n2C | CC(=O)N1N=C(c2ccsc2)C[C@H]1c1ccsc1 | 0.516164 |
CCc1nc(C)c(CN2CCC[C@H](C(=O)c3cccc(OC(C)C)c3)C2)[nH]1 | COc1ccc(OC)c(CCNc2nc3ccccc3c3nc(-c4cccnc4)nn23)c1 | 0.594566 |
Clc1ccc2c(c1)CN(Cc1nc(-c3cnccn3)no1)CCO2 | O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCOCC1 | 0.511521 |
Cc1nn(-c2ncccn2)c2c1[C@@H](c1c(F)cccc1F)CC(O)=N2 | COc1ccc(S(=O)(=O)Nc2cnccc2NC(C)=O)c(C)c1 | 0.56 |
CN(c1ccc(C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1)S(=O)(=O)c1ccccc1 | CC1=C(C(=O)OCc2ccccc2)[C@@H](c2cccc(F)c2)NC(=O)N1 | 0.546943 |
CCOc1ccccc1N1C(=O)N=C(O)/C(=C/NCCCn2ccnc2)C1=O | NC(=O)COc1ccc(C(=O)OCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1 | 0.513721 |
CC[C@H](NC(=O)[C@H](CC)N(c1cc(C)ccc1C)S(C)(=O)=O)c1ccc(C)cc1C | C=CCOc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCCCCC3)ccc2OC)c1 | 0.624865 |
NC1CCC(NC(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)CC1 | Cc1cc(C)c(C(=O)N2CCC(c3nc(O)cc(-c4ccccn4)n3)CC2)c(=O)[nH]1 | 0.640084 |
O=C(NC[C@@H](c1ccc(F)cc1)N1CCCC1)c1ccn(C(F)F)n1 | C[C@H](Cn1cncn1)NC(=O)N1CC2(CCCC2)c2ccccc21 | 0.526258 |
O=C1N[C@@H]2[C@@H](Cc3ccccc3O)c3ccccc3CN2c2ccccc21 | COc1cc([N+](=O)[O-])cc(/C=N/c2c(O)ccc3ccccc23)c1O | 0.533684 |
O=C(O)c1c2c(nc3ccccc13)/C(=C\c1ccc(-n3cncn3)c(F)c1)CC2 | Cc1ccnn1-c1ccc(C(=O)N2CCN(c3ncccn3)CC2)cc1 | 0.574153 |
CCCc1nnsc1C(=O)N1CCO[C@H](c2cc(Cl)cc(Cl)c2)C1 | C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C(=O)N1CCC(C)CC1)c1ccccc1 | 0.509132 |
COC(=O)[C@]1(C)N[C@H](c2ccc(F)cc2)[C@@H]2C(=O)N(C)C(=O)[C@@H]21 | CCc1oc(C(=O)N(CCCO)Cc2cccs2)cc1CN1CCCC1 | 0.621788 |
CC(=O)c1ccccc1NC(=O)Cc1ccc(-n2cccn2)cc1 | Cc1cc(C)c2c(-n3cccc3)c(C(=O)Nc3cc(C)on3)sc2n1 | 0.502629 |
Cc1ccc(NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1C | COC(=O)[C@@H](C)Sc1nnc(-c2ccccn2)n1-c1ccc(C)cc1C | 0.514501 |
O=C(N1CC2(C1)CS(=O)(=O)[C@@H](Cn1cnc3ccccc31)CO2)C1(F)CC1 | C[C@@H](O)C12c3ccccc3C(c3ccccc31)[C@@H]1C(=O)N(c3ccccc3C(F)(F)F)C(=O)[C@@H]12 | 0.707243 |
N#Cc1c(-c2ccco2)c2c([nH]c1=S)CCCC2 | COC(=O)c1ccc2c(c1)O[C@@H](C)C(=O)N2C | 0.53212 |
COc1ccccc1CCNC(=O)Cc1csc(NC(=O)c2ccc(OC)c(OC)c2)n1 | CCCn1nc(C(=O)N2CCN([C@H](C(=O)OCC)c3ccc(Cl)cc3)CC2)c2ccccc2c1=O | 0.593256 |
O=C(c1ccccc1)[C@H]([C@H](Nc1ccccc1)c1ccccc1)N1CCOCC1 | Cc1ccc(C)c2c(C)c(C(=O)N3CCC(N4CCOC4=O)CC3)[nH]c12 | 0.55398 |
CC(C)N1C[C@H](C(=O)N(C)C2C3CC4CC(C3)CC2C4)CC1=O | COCCN1C(=O)CCC[C@@H]2[C@H]1CCCN2CC1(O)CCCCCC1 | 0.52 |
O=C1c2ccccc2N[C@@H](c2cccc3ccccc23)N1C1CC1 | COc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(OC(C)C)cc1 | 0.55618 |
Cc1cc(N)cc2nc(-c3cc(Br)ccc3Cl)oc12 | C[C@H](N)[C@H]1CCCN(C(=O)c2oc3ccccc3c2CN(C)C)C1 | 0.561441 |
O=C1Oc2ccccc2C(=O)/C1=C\N1C(=O)N/C(=C/c2cccc(O)c2)C1=O | Nc1cc(C(=O)N2C[C@H](C[C@@H]3COCCN3)c3ccccc32)ccn1 | 0.660494 |
CCc1oc(C(=O)N2[C@H]3CC[C@@H]2[C@](CC)(CO)C3)cc1CN1CCCC1 | COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1cccc(F)c1 | 0.682977 |
O=C(NCCc1ccccc1)c1cc(-c2ccccc2)n([C@H]2CCS(=O)(=O)C2)n1 | Cc1csc([C@@H]2CCCN(CCOc3cccc(C(=O)O)c3)C2)n1 | 0.513602 |
COc1cc(OC)cc(C(=O)c2ccc(C(=O)Nc3sc4c(c3C#N)CCC4)cc2)c1 | COc1cc([C@H]2CC(=O)Nc3nc(N4CCCCCC4)nc(O)c32)ccc1O | 0.707216 |
CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)c2cc3ncc(Br)cn3n2)C1 | O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1coc2cc(O)ccc12 | 0.586623 |
C[C@H](CCc1ccc(O)cc1)N1CCC2(CC1)Nc1ccccc1NC2=O | CN(Cc1ccsc1)C(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F | 0.502762 |
CCOc1ccc(CN2CCCC[C@@H]2c2n[nH]cc2C(=O)O)nc1 | CC(=O)N1CC[C@H](NC(=O)c2nn(C)c3c2CCCC3)[C@@H](O)C1 | 0.664195 |
CCOCCn1c2c(=O)[nH]c(=O)n(C)c2n2c(-c3ccc(F)cc3)nnc12 | CCn1c([C@H]2C[C@H]2c2ccc(Cl)cc2)n[nH]c1=S | 0.563467 |
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cccc([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1cccc([N+](=O)[O-])c1 | CCc1nc(CC(=O)N2CCC[C@@H](n3cccn3)C2)cs1 | 0.585075 |
COc1cc(OC)cc(C2=NN(C(=O)c3ccccc3)[C@H](c3cccc(OC)c3)C2)c1 | O=C(c1ccc(-n2cccn2)cc1)N1CCC(n2c([C@H]3CCCO3)nc3cccnc32)CC1 | 0.678608 |
Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](C)Oc1cccc(Cl)c1)CC(C)(C)O2 | COc1cnccc1[C@@H](C)NC(=O)N(CC1CC1)C1CCCCC1 | 0.521008 |
NC(=O)NCC(=O)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc2C1 | O=C(Nc1cccnc1)[C@@H]1CN(C(=O)c2ccc(F)c(F)c2)CC12CCOCC2 | 0.579841 |
N#Cc1ccnc(OC[C@@H]2CCCN(c3cc(C(F)(F)F)ncn3)C2)c1 | Cc1nc(NC(=O)COc2ccccc2Cl)sc1-c1nc(-c2cccs2)no1 | 0.561105 |
CCOP(=O)(OCC)c1nc(-c2ccc(F)cc2)oc1N(C)C | COc1cc2c(cc1OC)C1(CCN(C(=O)c3sccc3C)CC1)OCC2 | 0.612033 |
Cc1sc2ncnc(SCCC(=O)N3CCC(F)(F)[C@@H](CO)C3)c2c1C | O=C(NCc1csc(-c2cccs2)n1)[C@@H]1NCCc2[nH]cnc21 | 0.617895 |
CCN(C(=O)[C@@H](C)Sc1nc2ccccc2c(=O)n1CC(=O)OC)c1ccccc1 | O=C(O[C@@H](C(=O)N1CCCC1)c1ccccc1)c1cnn(Cc2ccccc2)c1 | 0.556375 |
Cc1ccc(C)c(-n2nnnc2SCC(=O)N2CCCc3ccccc32)c1 | O=C(Nc1cccnc1)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1 | 0.50275 |
Cc1c(CNC(=O)Nc2ccccc2CN2CCOCC2)oc2ccccc12 | O=C1/C(=C/c2cc3ccccc3oc2=O)SC(=S)N1c1cccc(F)c1 | 0.62013 |
O=C(Cn1c(=O)c(F)cn([C@H]2CCCO2)c1=O)N1CCC(Cc2ccccc2)CC1 | COc1ccc(CC(=O)Nc2ccc(Cn3cnc(C(=O)Nc4ccccc4C)c3)cc2)cc1OC | 0.584826 |
O=C(O)c1ccc(C(=O)N2CCN(c3ncnc4sccc34)CC2)cn1 | COc1cccc([C@@H]2/C(=C(\O)c3ccccc3)C(=O)C(=O)N2CCCN(C)C)c1OC | 0.70404 |
CCn1c(N)c(C(=O)NC)c(=O)c2ccc(Cl)nc21 | CC(=O)Nc1ccc(C(=O)[C@@H](C)Sc2nnnn2C[C@H]2CCN(C)C2)cc1 | 0.558916 |
CCOc1ccc2[nH]c(=O)c(CN(Cc3nnnn3C(C)(C)CC)C3CCCCC3)cc2c1 | O=C(c1ncoc1-c1ccc2ccccc2c1)N1CCN(c2ccccc2F)CC1 | 0.593487 |
Cc1nc(-c2cccc(C(=O)N[C@](C)(C(=O)O)C3CC3)c2)cs1 | COc1ccc(/C=N\Nc2nnc3c4cc(Br)ccc4n(C)c3n2)cc1 | 0.552095 |
COc1cccc2c1CCCN(c1ncc(S(N)(=O)=O)s1)C2 | Cn1cc(-c2cnc3nc4c(cc3c2)CN(Cc2ccc(C#N)cc2F)CC4)cn1 | 0.617708 |
COC(=O)c1[nH]c2c(c1C)C(=O)C[C@@H](c1ccccc1)C2 | Cc1cccc(N2C(=O)[C@H]3[C@@H](ON(c4ccccc4)[C@H]3c3cccc(Cl)c3)C2=O)c1 | 0.739261 |
C/N=C1/S/C(=C\c2cc(C)n(-c3sc4c(c3C#N)CCCC4)c2C)C(=O)N1C | CCOC(=O)[C@@]1(c2ccccc2)N[C@@H](c2ccc(O)c(OC)c2)[C@H]2C(=O)N(C)C(=O)[C@@H]21 | 0.860784 |
Cc1cc(C(=O)COC(=O)CCNC(=O)c2ccco2)c(C)n1Cc1ccccc1 | CN(Cc1nc(N2CCOCC2)c2ccc(Cl)cc2n1)Cc1ccccc1C(F)(F)F | 0.553781 |
CC(C)C(=O)N1CCCc2cc(NS(=O)(=O)C3CCCCC3)ccc21 | CCCc1noc2c1/C(=N\OC(C)=O)CC(C)(C)C2 | 0.511526 |
Cc1ccc(-c2cc3c(=O)n(Cc4nc(-c5ccc6c(c5)OCO6)no4)ncn3n2)c(C)c1 | COc1cccc(Oc2ccc(Cl)cc2NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 | 0.562887 |
COCCn1c(COc2cccc(OC)c2)nnc1SCC(=O)N1CCOCC1 | CN(CC(=O)NN1C(=O)NC2(CCCCC2)C1=O)Cc1nc2ccccc2s1 | 0.586393 |
CN(CC1CCN(CCc2ccc(F)cc2)CC1)C(=O)c1n[nH]c2ccccc12 | Cc1cc(C)c2[nH]c(C(=O)N3CCCN(c4ccncc4C)CC3)c(C)c2c1 | 0.583146 |
CCN(CC)Cc1cccc(NC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)c1 | C[C@@H]1COc2ccccc2N1C(=O)c1cnc(N(C)C)cn1 | 0.588043 |
Cc1nnc(CNC(=O)C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)s1 | CCOc1ccc(C(=O)Nc2cc(OC)c(OC)cc2C(=O)OC)cc1COc1ccccc1OC | 0.56 |
C[C@@]12C[C@H]1CN(Cc1cnc3c(-c4ccccc4)cnn3c1)C2 | CC[C@H]1N=C(c2ccc(OC)c(OC)c2)c2cccn2-c2cc3c(cc21)OCCO3 | 0.589613 |
Cc1cc(S(=O)(=O)NC(C)C)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1C | O=C1Nc2ccccc2/C1=N/N=C/c1ccc([N+](=O)[O-])cc1 | 0.509852 |
CN(CC(=O)Nc1ccc2c(c1)OCCCO2)S(=O)(=O)c1ccc2c(c1)OCCO2 | O=C1C[C@H](C(=O)NCc2cn(Cc3ccccc3)nc2-c2ccccc2)c2ccc(F)cc2N1 | 0.575726 |
Cc1c(C(=O)N2c3ccccc3CCc3ccccc32)cccc1[N+](=O)[O-] | O=C(C[C@H]1C(=O)N=C2Nc3ccccc3N21)NCc1ccccc1 | 0.569429 |
O=C1N(Cc2ccncc2)CCO[C@]12CN(Cc1cccs1)C[C@H]2c1cccnc1 | CCn1c(=O)oc2cc(S(=O)(=O)Nc3cc(Cl)ccc3C)ccc21 | 0.643514 |
O=C(NC1CCCCC1)[C@H](c1ccccc1)N(Cc1cccnc1)C(=O)c1csnn1 | CCn1nc(C(C)C)cc1C(=O)NCc1sc(C)nc1C | 0.570499 |
O=C(C[n+]1nc(CNc2ccc(Br)cc2)n2c1CCCCC2)c1ccc(Cl)cc1 | CC1=C(C(N)=O)[C@H](c2ccncc2)N2NC(c3cccs3)=NC2=N1 | 0.723489 |
O=C(NCCCN1CCc2ccccc21)[C@@H]1CCC(=O)N(CCc2ccccn2)C1 | O=C(O)c1cc(S(=O)(=O)N(Cc2ccco2)c2ccccc2)ccc1F | 0.50558 |
Cc1cc(C)n([C@@H]2CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)n1 | CNC(=O)c1cc(S(=O)(=O)Nc2ccc3c(c2)OCO3)ccc1OC | 0.536532 |
Cc1nc(CN2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cn1C | C[C@@H](O)c1nc2ccccc2n1C[C@H](O)COc1ccc(C(C)(C)C)cc1 | 0.627859 |
C=CCc1cc(/C=C/C(=O)c2ccc3c(c2)CC(=O)N3)cc(OC)c1O | CCc1cc2ncc(CN3CCN(c4ccc(C(=O)NC)nc4)CC3)cc2nc1O | 0.5375 |
C[C@@H](NC(=O)NC[C@@H](O)c1cnn(C)c1)c1csc(C2CC2)n1 | COc1ccc(CN2C(=O)N[C@H](CC(=O)N3CCCC4=C[C@H]5C[C@@H](CN6CCCC[C@H]56)[C@H]43)C2=O)cc1 | 0.559211 |
CCCC(=O)NC[C@@H](c1ccco1)N1CCc2ccccc21 | CC(=O)c1cc(C#N)c(SCCCOc2ccccc2)nc1C | 0.5 |
CCCCn1/c(=N\C(=O)c2ccc(C)cc2)c(C(=O)OCC)cc2c(=O)n3ccccc3nc21 | CCc1ccc(-n2c(=S)[nH]c(O)c(/C=N/c3ccc(Br)cc3)c2=O)cc1 | 0.691383 |
COc1ccc(CNC(=O)C[C@@H]2O[C@H](Cn3cc(CN(C)Cc4ccccc4)nn3)[C@@H](O)[C@H]2O)cc1 | CC(C)Nc1nc2c(S(=O)(=O)c3cccc(Cl)c3)nnn2c2ccsc12 | 0.677419 |
Cc1nc2c(C(=O)N3CCN(C)C4(CCN(C)CC4)C3)cccc2[nH]1 | Cc1cc(C)n(-c2cc(N3CCN(C(=O)Cc4c[nH]c5ccccc45)CC3)nc(C)n2)n1 | 0.625519 |
C[C@@H]1CCCC[C@]12NC(=O)N(CCC(=O)Nc1ccccc1C(=O)c1ccccc1)C2=O | Cc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@@H]2C=Cc4ccccc4N2[C@@H]3C(=O)n2nnc3ccccc32)c(C)c1 | 0.747012 |
COc1cncc(C(=O)N2CC[C@@H](C3CC3)[C@H]2c2nnc(O)n2C)c1C | CC(C)n1nccc1NC(=O)[C@H](C)Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 | 0.762189 |
CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cccn1-c1ccccc1C(=O)OC | COc1ccc(-c2n[nH]cc2CN(C)C[C@H]2CCCN(CCc3ccccc3OC)C2)cc1 | 0.579381 |
CCCCN(C)C(=O)Cn1c([C@@H]2CC(=O)N(c3ccc(C)cc3)C2)nc2ccccc21 | Cc1cnc(-c2nnc([C@H]3CCCCN3S(=O)(=O)c3cccc(F)c3)o2)cn1 | 0.718719 |
COc1ccc(Cl)cc1CC(=O)N[C@]1(C(N)=O)CCCOC1 | CCOc1ccc(Cl)cc1S(=O)(=O)Nc1ncccc1C | 0.500582 |
COc1ccc(OC[C@H](C)NC(=O)CCc2cc(S(=O)(=O)N3CCOCC3)ccc2OC)cc1 | CCN1[C@H](Cc2cccn2C)[C@H](O)c2ccccc2S1(=O)=O | 0.618378 |
CC(C)(C)C(=O)N[C@H]1CCCN(c2ncc(Br)cc2C(F)(F)F)C1 | c1cc(NC2CCN(c3cnccn3)CC2)cc(Oc2cnccn2)c1 | 0.5 |
CC(C)Cc1ncc2c(n1)CN(C(=O)[C@H]1CC(=O)Nc3ccc(F)cc31)C2 | COCCCn1c(=O)c2ccccc2n(CC(=O)N2CCOc3ccc(C)cc32)c1=O | 0.724449 |
COCc1ccccc1-c1cnc2n1CCN(C(=O)CC1CCCCC1)CC2 | Fc1ccc2oc(NC[C@@H]3CCc4nccn4C3)nc2c1 | 0.590076 |
CCN([C@@H](C)C(=O)O)S(=O)(=O)c1cc(C(=O)O)oc1C | CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2nc3ccc(F)cn3n2)cc1 | 0.558598 |
C=CCNC(=O)CSc1nc2cc(-c3ccc(C)cc3)sc2c(=O)n1Cc1ccccc1 | COc1ncccc1NC(=O)/C=C/c1c(Cl)nc2ccccn12 | 0.595657 |
Cc1cccc2c1N[C@@]1(NC2=O)C(=O)N(C)c2ccccc21 | Cc1nn(C)c(C)c1CCC(=O)NC[C@@H]1COc2ccccc2C1 | 0.556575 |
CC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H]4CCCN4[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@H]3C2=O)cc1 | CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(N3CCCCC3)cc2)c1 | 0.547431 |
COc1ccc(N2CCN(C(=O)c3ccc(-n4nc(C)cc4C)cc3)CC2)cc1 | Cc1sc2nc(-c3cccs3)nc(N(C)Cc3nccn3C)c2c1C | 0.581322 |
CC[C@H](NC(=O)c1cc(S(=O)(=O)N2CCC(C)CC2)ccc1OC)c1ccccc1 | COc1ccc(-c2cn3nc(CNc4ccc5c(c4)OCO5)n4c3c2CCCC4)cc1 | 0.644869 |
CCc1cc(NC(=O)[C@H]2OCC(=O)N(CC)[C@@H]2c2nccn2C)ccc1C | COc1ccc(O[C@@H](C)c2nc(-c3cccnc3)no2)cc1 | 0.525516 |
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