p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
CCc1ccc(CN2CC[C@@]3(C2)CN(c2cccc(F)c2)C(=O)CO3)cc1 | Cn1ncc(N2CC[C@@H](CNC(=O)C3CCS(=O)(=O)CC3)C2)cc1=O | 0.543093 |
Cc1ccc(S(=O)(=O)N[C@@H](CC(=O)NCc2ccco2)c2ccccc2)cc1 | Cc1ccc(C)c(Nc2cnn([C@]34C[C@@H]5C[C@@H](C[C@](C(=O)O)(C5)C3)C4)c(=O)c2Cl)c1 | 0.538126 |
CO[C@@H]1C[C@H](c2nc(C)no2)N(Cc2ncc(C(C)(C)C)o2)C1 | COCCNC(=O)c1cnc2n1[C@H](CNC(=O)C1CC(F)(F)C1)CC2 | 0.602725 |
CC[C@@H](C)NC(=O)c1ccccc1NC(=O)CN(c1ccc(Cl)cc1Cl)S(C)(=O)=O | COc1ccc(-c2nnc([C@@H](C)N3CCN(c4cnn(-c5ccccc5)c(=O)c4Cl)CC3)o2)cc1 | 0.659138 |
CNc1nc(N2CCn3nc(CNC(=O)C4CCCC4)cc3C2)ncc1F | CC[C@H](c1nnnn1Cc1ccccc1)N(Cc1ccco1)Cc1cc2ccc(C)cc2[nH]c1=O | 0.615305 |
O=C(O)c1ccc(COc2ncnc3c(Cl)cc(Cl)cc23)cc1 | COCCn1cc([C@H]2[C@H](CNC(=O)c3ccncc3F)CC(=O)N2C(C)(C)C)cn1 | 0.506064 |
O=C(c1cccc(Cl)c1)N1CCC[C@@H](c2nc3c(nnn3Cc3cccc(Cl)c3)c(=O)[nH]2)C1 | C[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2nnc3ccccn23)C1 | 0.660606 |
O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(Cc1ccccc1F)C1CC1 | CCSc1nc(=O)c2c(n1C)NC(=O)C[C@H]2c1ccc(C)cc1 | 0.592554 |
Cc1cc(SCc2ccccc2Cl)nc(-c2ccccn2)n1 | CCOCc1cnc2n1CCN(S(=O)(=O)c1cn(C)cn1)[C@H]2C | 0.531447 |
C=CCN1C(=O)/C(=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)c2ccccc21 | O=C(Nc1cc(-c2c(F)cccc2F)[nH]n1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 | 0.673674 |
Cc1cc(C)c2c(CC(=O)N3CCC[C@H](c4nc(-c5cccnc5)no4)C3)c(C)[nH]c2c1 | O=C(Nc1ccc(Cl)c(N2CCCS2(=O)=O)c1)c1c(F)cccc1F | 0.6138 |
COC(=O)c1cc(Nc2cnn(C34CC5CC(CC(C5)C3)C4)c(=O)c2Cl)cc(C(=O)OC)c1 | Cc1cc2nc(N[C@@H](C)c3nnc4ccccn34)c3ccccc3n2n1 | 0.675179 |
CCn1ccnc1N1CCN(CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)CC1 | Clc1ccc(CN2CC[C@]3(COCc4cnc(-c5ccccc5)nc43)C2)cc1 | 0.547696 |
COc1ccc(Cn2nnnc2[C@H](c2ccc(OC)cc2)N2CCN(c3cccc(C)c3C)CC2)cc1 | Cc1cc(N[C@H](CN2CCCC2=O)c2ccccc2)n2ncnc2n1 | 0.608604 |
Cc1nc(-c2cccnc2)nc(O)c1CC(=O)N[C@H](C)CC(F)F | COc1cc2c(cc1NC(=O)N(C)Cc1nccs1)n(C)c(=O)n2C | 0.533702 |
C=C(C)CSc1nnc2n(-c3ccccc3)c(=O)c3c4c(sc3n12)CCC4 | C[C@H]1C[C@H](C)CN(C(=O)COC(=O)CCc2nc3ccccc3c(=O)[nH]2)C1 | 0.558163 |
CC[C@@H](NC(=O)c1ccc(N(Cc2ccccc2F)S(C)(=O)=O)cc1)c1ccc(C)cc1 | NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccccc1 | 0.553191 |
C[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)OCC(=O)c1ccc(Br)s1 | CCOC(=O)Cn1c(=N)n(Cc2ccccc2F)c2ccccc21 | 0.579937 |
CCc1cnc(N2C[C@H]3CN(C(=O)C4CCCC4)C[C@@]3(C(=O)O)C2)nc1 | CSc1ccc([C@@H]2c3c(oc4ccccc4c3=O)C(=O)N2CCCOC(C)C)cc1 | 0.573034 |
COc1ccc(C(=O)NC2CCC(O)CC2)cc1-c1ccccc1 | Cc1ccccc1-c1noc(CN2N=N[C@H]3C(=O)N(c4cccc(Cl)c4)C(=O)[C@H]32)n1 | 0.501548 |
Cc1nn(C)cc1-c1ccc(C(=O)NCc2csc(N3CCCC3)n2)cc1 | COc1ccc(C)cc1NC(=O)[C@@H](C)OC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1 | 0.568433 |
COc1ccc(Cl)cc1N([C@H](C)C(=O)NCCOc1cc(C)ccc1C)S(C)(=O)=O | CN(C)S(=O)(=O)N1CCOC[C@H]1c1nccc(NC2CCC2)n1 | 0.52422 |
CCn1cnc2c1c(=O)n(CC(=O)Nc1ccccc1Cc1ccccc1)c(=O)n2Cc1ccccc1 | COc1ccc(-c2ccc(=O)n(CCNC(=O)c3ccc4ccccc4n3)n2)cc1 | 0.634694 |
COCCc1nc(CCSC)n(Cc2ccccc2C)n1 | COc1ccc2[nH]c3c(c2c1)CCC[C@H]3NC(=O)CN1C(=O)CC2(CCCC2)C1=O | 0.509052 |
Cc1nc(C(=O)NC[C@]2(C)OCCc3sccc32)c2ccnc-2[nH]1 | CCCOc1ccccc1NC(=O)CCc1c(C)nc2c3ccccc3nn2c1C | 0.699294 |
CS(=O)(=O)N1C[C@H]2CC[C@@H](C1)N(C(=O)COc1ccc3nncn3n1)C2 | Cn1cccc1/C=C1/S/C(=N\c2ccc(Cl)c(C(F)(F)F)c2)NC1=O | 0.582979 |
C=CC(=O)N(C)CC(=O)N[C@H]1CCCN(c2ccc(F)cc2F)C1=O | COc1ccccc1N1CC[C@@H](NC(=O)c2ccnnc2C)C1 | 0.54733 |
COc1cc(OC)c(/C=N/N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C2)cc1Cl | CNC(=O)C1(NC(=O)c2ccc(-c3nccn3C)cc2)CCCCC1 | 0.507585 |
O=c1c2c3c(sc2ncn1CCc1cn[nH]c1)CCC3 | CCCCC(=O)NC(=S)Nc1cccc(-c2nn3c(CC)nnc3s2)c1 | 0.655497 |
CN1CC[C@@H](Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1=O | Cc1ccc(CSCCNC(=O)c2sc3nc(Cc4ccccc4)[nH]c(=O)c3c2C)cc1 | 0.50974 |
O=C(CC1CCCC1)N1CCC[C@@H]1c1cccc(CN2CCOCC2)n1 | COCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1cc(F)ccc1F | 0.607287 |
Cc1nc(N2CCC[C@@H]2C(=O)N[C@@H]2CCc3ccccc32)nc2cc(S(C)(=O)=O)ccc12 | CCOC(=O)C1=C(C)N=c2s/c(=C/C=C/c3ccccc3)c(=O)n2[C@H]1c1ccc(C)cc1 | 0.762611 |
Cn1cnnc1C[C@@]1(O)CCCN(S(=O)(=O)c2ccccc2)C1 | CCOC(=O)c1ccc(NC(=O)COC(=O)[C@H](C(C)C)N2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]3C2=O)cc1 | 0.516593 |
CCOc1ccc2c(c1)[C@@H](NC(=O)c1cnc(CC)nc1O)CCO2 | Cc1c(Cl)cccc1N(CC(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1)S(C)(=O)=O | 0.55298 |
CN(Cc1ccccc1NC(=O)Cn1nnn(-c2cccs2)c1=O)C1CCCCC1 | CSc1nc2nc(C)c(CCC(=O)Nc3ccc4c(c3)CCC4)c(C)n2n1 | 0.634576 |
C=CCN1c2cc(OC)c(OC)cc2C(C)=C(C(=O)NCC2=CCCCC2)S1(=O)=O | O=C(Cn1cnc2ccccc21)Nc1ccc(C(=O)O)cc1 | 0.524341 |
CCCNC(=O)[C@H](C)NC(=O)c1cc(-c2ccccc2)c(N2CCOCC2)s1 | COC(=O)[C@H]1CCC[C@@H]1c1nc(-c2ccsc2)no1 | 0.527352 |
COc1ccc([C@H]2[C@@H](C(=O)Nc3ccccc3OC)[C@H](C)Nc3ncnn32)c(OC)c1 | CCOC(=O)c1ccc(NC(=O)N2CCN(c3cc(Cl)ccc3C)CC2)cc1 | 0.510725 |
Cc1ccc2c(C)nc(Nc3nc(C)c(Cc4ccccc4)c(=O)[nH]3)nc2c1 | Cc1cc(C)c(-c2noc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)c(Cl)n1 | 0.544962 |
CN(C)[C@H](C(=O)N1CCC(O)(CO)CC1)c1ccc2c(c1)OCO2 | COc1ccc(-c2noc(CN(C)C(=O)COc3ccc(C(C)(C)C)cc3)n2)c(OC)c1 | 0.521739 |
O=C(c1cc(=O)c2ccc(Br)cc2o1)N(Cc1ccccc1F)[C@H]1CCS(=O)(=O)C1 | Cc1ccc(OC2(C(=O)O)CCN(C(=O)[C@@H]3CC=CCC3)CC2)c(C)n1 | 0.511135 |
CCc1ccc(N2C(=O)NC(=O)/C(=C/c3cc(C(C)C)c(OC)cc3C)C2=O)cc1 | CSc1ncc(Cl)c(C(=O)N(Cc2ccc(F)cc2)[C@@H]2CCS(=O)(=O)C2)n1 | 0.593395 |
CN(C(=O)c1ccc(-n2[nH]c(O)nc2=O)cc1)c1ccn(C)n1 | CC(F)(F)c1cccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)c1 | 0.536613 |
C[C@@H]1CN(C(=O)c2ccccc2CSc2nc3ccccc3o2)C[C@@H](C)O1 | C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N1CCN(c3ccc(O)cc3)CC1)C2=O | 0.523705 |
CCc1ccc(CN(C)C(=O)c2cc(CN3CCC(O)CC3)on2)cc1 | COCc1nn2c(c1-c1ccccc1)N=C(O)C[C@H]2C(=O)Nc1ccccc1OC | 0.529412 |
CCc1nc(N2CCN(C(=O)COc3ccc(F)cc3)CC2)c2c(n1)c(C)nn2C | Cc1ncoc1C(=O)N1CCC[C@H](c2ncc(Cc3ccc(F)cc3)o2)C1 | 0.635066 |
COC(=O)c1ccccc1-c1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2C[C@@H]2CCCO2)o1 | O=C(CSc1nnc(C[C@@H]2CCS(=O)(=O)C2)o1)N1CCN(c2ncccn2)CC1 | 0.612711 |
COc1ccc(NC(=O)CC[C@@H]2CCCN(Cc3ccc(-n4cccn4)cc3)C2)c(C)c1 | COCC(=O)N[C@H]1[C@H](c2cccs2)N(C(=O)c2ccc(OC)cc2)CC[C@@]1(C)O | 0.57339 |
Cc1nn(C)c(N(C)C)c1CNCc1ccccc1OCCN(C)C | O=S(=O)(c1cccc2nsnc12)N1CC[C@@H](c2ccc3c(c2)OCO3)C1 | 0.551948 |
COC(=O)c1cc2cc(CNCCn3ccnc3)sc2[nH]1 | O=C1C(=O)N(c2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])/C1=C(O)/C=C/c1ccccc1 | 0.631791 |
COc1ccc(-c2nn3cc(-c4ccccc4)nc3s2)cc1OC | O=C1C[C@@H](C(=O)N2CCC[C@@H]2c2cccs2)CN1c1ccccc1Br | 0.568277 |
O=C1CC[C@H](C(=O)N(Cc2cccs2)C2(C(=O)NC3CCCC3)CCCCC2)N1 | CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)c1ccoc1C)CC2 | 0.542012 |
O=C(/C=C/c1ccccc1)Nc1nc2ccc(S(=O)(=O)N3CCOCC3)cc2s1 | Cc1noc(C)c1CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 | 0.582659 |
Cc1ncsc1-c1nc(-c2ccc3cc[nH]c3c2)no1 | CSc1nc2n(n1)[C@H](c1cccs1)C1=C(C[C@@H](c3ccco3)CC1=O)N2 | 0.663033 |
C[C@H](Oc1ccccc1F)C(=O)N(Cc1ccccc1Cl)c1ccccn1 | COC(=O)c1ccc2c(O)nc(CN(C)[C@H](C)c3cc4ccccc4o3)nc2c1 | 0.574132 |
CC(=O)c1cc(CCC(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)oc1C | C[C@H]1CCN(C(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c2ccccc2S1 | 0.572826 |
Cc1csc([C@@H]2CCCCN2C(=O)CCCn2cncn2)n1 | Cc1ccnc(-c2n[nH]c([C@@H](C)NC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)n2)c1 | 0.528282 |
CN(Cc1nccn1C(F)F)C(=O)c1conc1C(C)(C)N | O=C(O)COc1cccc(C(=O)N2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1 | 0.577586 |
Cc1noc(C[C@H]2CO[C@@H]3CN(Cc4ccc5c(c4)OCO5)C[C@H]23)n1 | CC1=C(C)C[C@@H](C(=O)Nc2sc3c(c2C(N)=O)CCCC3)[C@H](C(=O)O)C1 | 0.621567 |
COCCN(C(=O)Cc1ccc(OC)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 | COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 | 0.598281 |
COc1ccc(-c2csc(NC(=O)CSc3nnc(-c4ccc(Cl)cc4)n3N)n2)cc1 | COc1cc([C@@H]2Nc3ccccc3-c3nnc(SC)nc3O2)ccc1OCC(=O)O | 0.680612 |
C=C(C)CN1C(=O)N[C@@](CC)(C2CCN(C(=O)c3ccc4ncccc4c3)CC2)C1=O | CCC[C@@H](OC(=O)c1ccc(N(C)C)cc1)C(=O)Nc1cc(C)on1 | 0.541573 |
COc1cccc(C(=O)N(Cc2ccc(Cl)cc2Cl)[C@@H]2CCS(=O)(=O)C2)c1 | Cc1cc([C@H](C)N[C@@H]2C[C@@]3(CCNC3)Oc3ccccc32)nn1C | 0.567391 |
O=C(O)c1cc(Cl)c2c(F)ccc(Br)c2n1 | CNC(=O)[C@H]1Cc2cc(OC)c(OC)cc2CN1C(=O)Cn1c(C)ccc1C | 0.53606 |
Cc1nn(C)c2c(=O)n(Cc3cccc4ccccc34)cnc12 | CCOC(=O)c1cc(OC)n(-c2ccc(C)cc2)n1 | 0.529221 |
Cc1ccc(C(=O)NC[C@H]2CCCN3CCCC[C@@H]23)c(-n2cnnn2)c1C | CCOC(=O)c1cccnc1-c1ccc2[nH]ccc2c1 | 0.505017 |
O=C1Oc2ccccc2C(=O)/C1=C\N1C(=O)CNC1=S | C[C@@H](OC(=O)[C@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O)C(=O)Nc1ccc2ccccc2c1 | 0.584388 |
COc1ccc(CNC(=O)COC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1 | COc1ccc2nc(SCC(=O)N(Cc3ccccc3)Cc3ccco3)[nH]c2c1 | 0.533947 |
CCOC(=O)/C=C/c1ccc(F)c(Cl)c1 | CCCCOc1c(C)cc(NC(=O)[C@](C)(CC)OCC)cc1C | 0.241653 |
COc1cc(NC(=O)CSc2nc3cc(C)c(C)cc3cc2C)cc(OC)c1 | Cc1ccc(N2C(=O)[C@H]3N=NN(c4ccc(Cl)cc4)[C@H]3C2=O)cc1F | 0.544885 |
COc1ccc([C@H]2CCCCCN2C(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 | CCOC(=O)c1cnc(SCC(=O)Nc2cc(Cl)ccc2Cl)nc1N | 0.516685 |
Cc1c(C(=O)N(C)Cc2nc3ccccc3n2C(F)F)cnn1-c1cccc(Cl)c1 | CCNC(=O)c1nn(Cc2cccc(OC)c2)c2c1CN(C(=O)c1n[nH]c3c1CCC3)CC2 | 0.73716 |
C[C@@H]1CCCC[C@@H]1[C@H](C)NC(=O)c1nnc2c(F)cccc2c1O | Cc1ccc(-n2c(SCC(=O)N3CCNC3=O)nc3ccccc3c2=O)cc1C | 0.608193 |
Cc1nc(C)n(Cc2cccc(NC(=O)NCc3cccc(C(F)(F)F)c3)c2)n1 | Cc1cc(=O)oc2cc(OCC(=O)c3cc(C)n(Cc4ccc5c(c4)OCO5)c3C)ccc12 | 0.525134 |
CNS(=O)(=O)c1cccc(-c2noc([C@H](C)Cc3c(C)nn(C)c3C)n2)c1 | Cc1ccc(-n2nc3c4cc(C(=O)N[C@H](C)c5ccc(F)cc5)ccc4[nH]cc-3c2=O)cc1 | 0.652352 |
Cc1cc(O[C@H](C)C(=O)N[C@@H](Cc2c[nH]c3ccc(O)cc23)C(=O)O)c2c3c(c(=O)oc2c1)CCC3 | Cc1c(C(=O)CN(C)C)c2cc(O)ccc2n1C | 0.69183 |
CCOC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1coc2cc3c(cc12)CCC3 | Cc1noc(C)c1CN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)[C@H]1CC[C@@H](O)CC1)C2 | 0.528177 |
Cc1cccc2cc(CN(Cc3ccc(F)cc3)C(=O)[C@@H]3CCCO3)c(=O)[nH]c12 | CC[C@H](NC(=O)c1ccc2nc(C)cn2c1)c1nc(C)c(C)s1 | 0.571429 |
O=C(Nc1ccccc1)c1cnn2c1CN(C(=O)C1(F)CC1)CCC2 | CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)C2(C=O)c4ccccc4C3(C)c3ccccc32)cc1 | 0.70284 |
C=CCN1C(=O)[C@@H]2[C@@H](C(=O)NC)[C@H]3C=C[C@@]2(O3)[C@H]1C(=O)NCc1ccc(OC)cc1 | CCc1nnc(-c2ccc(NC(=O)c3ccc(-c4ccccc4F)o3)cc2)o1 | 0.64467 |
Cc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)N(C)Cc2cccc3ncccc23)cc1 | COC[C@H](C)n1c(S[C@H](C)C(=O)NC(N)=O)nc2ccccc2c1=O | 0.523322 |
O=C1C[C@@H](c2cccc(O)c2)c2cc3c(cc2N1)OCO3 | CC(C)Cn1ncnc1CN1CCc2ncc([N+](=O)[O-])cc2C1 | 0.543803 |
c1ccc(C[C@@H]2Cc3nnc(Cn4ccnc4)n3C2)cc1 | Cc1ccccc1N1/C(=N\C(=O)c2ccccc2)S[C@@H]2CS(=O)(=O)C[C@@H]21 | 0.549061 |
Cc1nn(C)cc1S(=O)(=O)N1CCC[C@H](CN2CCCC2=O)C1 | Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N3CC[C@@H](Nc4ccccc4)C3)cc12 | 0.580982 |
C[C@]12C=C[C@](C)(O1)[C@H]1C(=O)N(c3ccc(Cl)c(C(=O)O)c3)C(=O)[C@@H]12 | Cn1ncc(N2CCO[C@@H](CCNC(=O)C3CCCCC3)C2)cc1=O | 0.543646 |
COc1ccccc1[C@@H]1CC(O)=Nc2c1c(=O)nc(SC)n2C | COc1ccc(OCCN2CC(=O)N(c3ccc(C(C)C)cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 | 0.694641 |
CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C(=O)c2ccoc2C)C1 | Cc1c(F)cc(C(N)=O)cc1NCc1nnc(-c2cccc(Cl)c2)o1 | 0.543502 |
COCCN1C(=O)[C@@H]2CC[C@H]1CN(c1nc(C)ccc1C(=O)O)C2 | CCSc1nnc2c(n1)O[C@@H](/C=C/c1ccco1)Nc1ccccc1-2 | 0.690743 |
CCc1nnc(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)n1C | Cn1cc(C(=O)O)c(-c2ccnn2C)n1 | 0.523446 |
Cc1ccc2nc(NC(=O)[C@@H]3CCCC[C@H]3C(=O)O)sc2c1 | CCOC(=O)C1CCN(Cc2ccc3c(NC(=O)c4ccco4)c(C(=O)OC)sc3n2)CC1 | 0.623457 |
O=C(Cc1cc(F)ccc1F)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 | CCc1nc2nnc3c(=O)n(-c4ccccc4O)ccc3n2n1 | 0.540773 |
COCCCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)C(C(=O)OC)=C1C | Cc1ccccc1OCCNC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O | 0.551983 |
Cc1csc(N2CCCN([C@H](C(N)=O)c3ccccc3)CC2)n1 | COC(=O)[C@@H]1C[C@H]1C(=O)N(c1nc(C)cs1)C1CC1 | 0.540541 |
O[C@@H]1C[C@H](c2ccc(F)cc2)N(Cc2nncn2-c2ccccc2)C1 | Cn1c(CNC[C@@H]2CCCO[C@H]2c2cn[nH]c2)nc2ccccc21 | 0.507328 |
CCOC(=O)CNc1ccc(Cl)cc1[C@H]1c2cc(OC)c(OC)cc2CCN1CC(=O)OCC | Cc1cc2oc3c(c(=O)c2cc1Cl)[C@H](c1cccc(Cl)c1)N(CCO)C3=O | 0.755556 |
Cc1ccc(CNC(=O)CN2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)cc1F | O=C(CCc1ccccc1)/N=C1\S[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc(F)cc1F | 0.538784 |
CSCc1ccc(C(=O)N2CCOC3(CCN(Cc4ccccn4)CC3)C2)o1 | COC1(C(=O)Nc2cc(C(=O)O)cc(S(C)(=O)=O)c2)CCC1 | 0.504454 |
Cc1[nH]c2nc(NCc3cccc(Cl)c3)nn2c(=O)c1C | CNC(=O)[C@@]1(COC)CCCN1C(=O)c1cnc(C)nc1N | 0.572354 |
COc1ccc(-c2noc([C@H]3CCCN3C(=O)c3cccc(C)c3)n2)cc1 | C#CCCC1(CCNC(=O)CCc2nc3ccccc3c(=O)n2C)N=N1 | 0.540894 |
COc1ccc(NC(=O)c2nn(-c3ccc(C)cc3)ccc2=O)cc1Cl | Cc1ccc(C(=O)N[C@@H](N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(Cl)(Cl)Cl)cc1 | 0.611399 |
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