p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
CCOc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)C1c3ccccc3C2(/C=N/O)c2ccccc21 | O=C(Nc1ccc2c3c(cccc13)CC2)[C@@H]1COc2ccccc2O1 | 0.586387 |
Cc1ccc(-c2cc(C(=O)NCCc3ccc(Cl)cc3)nn2[C@H]2CCS(=O)(=O)C2)cc1C | CCOC(=O)[C@]12CCCN[C@@H]1CCN(C(=O)NCc1ccc(C)cc1)C2 | 0.523659 |
CC(C)[C@@H]1C[C@@H](CC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)CCO1 | CCc1ncc(CN2C[C@H]3CCC[C@@H](C2)C3(O)c2ccc(OC)cc2)cn1 | 0.504065 |
CC(C)[C@](C)(C#N)NC(=O)CSc1ncnc2sc3c(c12)CCC3 | COc1ccc(-c2onc(N3CCCC3)c2C(=O)N(C)CCCO)cc1 | 0.656473 |
O=C(N[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3c(F)cccc3F)C[C@@H]12)c1cnc[nH]1 | CC(=O)N1CCc2c(nc(C)nc2NCCc2nc(C)c(C)s2)C1 | 0.637214 |
O=C(c1cc(-c2ccccc2)on1)N1CCC[C@]2(CCc3c[nH]nc32)C1 | O=S1(=O)C[C@@H]2[C@H](C1)N(Cc1c[nH]cn1)CCN2Cc1cccnc1 | 0.547872 |
CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2cc(OC)ccc2OC)cc1 | COc1ccc(CCC(=O)Nc2ccccc2C(=O)OCn2nnc3ccccc3c2=O)cc1 | 0.5028 |
C[C@@H]1C[C@H]1NC(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 | COc1cc(C(=O)O[C@@H](C)C(=O)NCc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OC | 0.545946 |
N#Cc1nc([C@@H]2C[C@H]2c2cccc(F)c2)oc1NC1CC1 | C[C@H]1C[C@H](C)CN(Cc2csc(NC(=O)CNC(=O)c3ccc4c(c3)OCO4)n2)C1 | 0.527991 |
CCOC(=O)[C@H]1CN(Cc2ccco2)C[C@@H]2CN(C(=O)c3cn(C)nc3C(F)F)CCN2C1 | N#CCCN(Cc1ccco1)C(=O)Cc1ccc(-n2cnnn2)cc1 | 0.517241 |
COc1ccccc1CNC(=O)C(=O)NCc1ccc(-c2ccsc2)o1 | CCCCCN1C(=O)[C@@H](C(=O)OCC)[C@@H](C(C)C)n2c1nc1ccccc12 | 0.582474 |
CC(C)CCN(CCC(C)C)C(=O)CN1C(=O)N[C@](C)(c2ccc3c(c2)CCC3)C1=O | CCOc1ccc(C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1Cl | 0.527412 |
CCCCN1C(=O)c2[nH]nc(-c3c(C)cc(C)cc3O)c2[C@@H]1c1cc(OC)c(OC)c(OC)c1 | CSc1ccc([C@H]2CCCN2Cc2ccccc2)cn1 | 0.518293 |
COc1cc(F)c(Br)cc1S(=O)(=O)N[C@H](C)C(=O)O | CCCS(=O)(=O)NCc1ccccc1OS(=O)(=O)CCC | 0.35347 |
COc1ccc(CNC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1C(=O)O | C=CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OCc2ccccc2)cc1 | 0.593819 |
COc1cccn(CC(=O)N2CCC[C@]3(CN(C)C(=O)O3)C2)c1=O | COc1ccc(Cl)cc1S(=O)(=O)NC[C@@H](c1ccsc1)N1CCCCCC1 | 0.530435 |
Nn1c(SCc2cc(=O)n3c(n2)sc2ccccc23)nnc1-c1ccccc1Cl | CCCc1nnsc1C(=O)N(Cc1ccoc1)Cc1cccs1 | 0.586889 |
COc1ccc(-c2nc3cc(C)ccc3cc2CN2CCC[C@@H](O)C2)cc1OC | CC1CCN(Cc2nnnn2CC(=O)NC[C@@H]2COc3ccccc3O2)CC1 | 0.540204 |
O=C(CN1C(=O)CNC1=O)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 | COC(=O)CCC(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@@H]1CCCO1 | 0.532609 |
O=C(/C=C/c1ccco1)N1CCC[C@@H](Cc2ccnc(Nc3ccccn3)c2)C1 | O=C(COc1ccc(F)cc1F)N1CCC[C@@H]1c1ncc(Cc2cccc(Cl)c2)o1 | 0.506682 |
CCc1ccc2c(c1)[C@H]1C[C@@](C)(O2)N(c2cc(C)cc(C)c2)C(=S)N1 | Cc1nn(CN2CCN(C(=O)c3ccc(C(C)C)cc3)CC2)c(=S)n1C | 0.579001 |
Cn1cccc(C(=O)NCCn2nc(C3CC3)ccc2=O)c1=O | Cc1nc2cc(NC(=O)N[C@@H]3CCO[C@H]3c3ccncc3)ccc2s1 | 0.545553 |
CCOc1cc(C)nc(N2CCN(C(=O)c3ncccc3O)CC2)n1 | O=C([C@H]1C[C@H]2CC[C@@H]1N2)N1CCc2nc(C3CCOCC3)nn2CC1 | 0.543011 |
COC[C@@H]1[C@H](NC(=O)C2(Cn3ccnc3)CC2)[C@@H]2CCO[C@H]12 | COc1cc2c(cc1O)CCN(C(=O)CC[C@H]1C(=O)Nc3ccccc31)[C@@H]2C | 0.529153 |
CCCCc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2ccc(Cl)cn2)cc1 | CC(C)c1c(Cc2ccccc2)c(=O)[nH]c2cc3c(cc12)OCCO3 | 0.553879 |
COc1ccc(CN(C=O)/C=C2/Sc3ccccc3C2=O)cc1OC | Cc1cc(NC(=O)Cc2noc3ccccc23)n(-c2cccc(C(F)(F)F)c2)n1 | 0.554497 |
Cc1c(CNC(=O)c2nc3ccccc3c(=O)[nH]2)oc2ccc(F)cc12 | O=S(=O)(c1ccc(N2CCN(C[C@H](O)c3ccc(F)cc3)CC2)nc1)N1CCOCC1 | 0.553863 |
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)c3nn(-c4ccccc4)c4c3CCC4)n2)cc1 | CC(=O)Nc1ccc(C(=O)N2CC[C@H](Oc3cnsn3)C2)cc1 | 0.51749 |
C[C@@H]1Oc2ccc(NC(=O)Cc3ccc(S(C)(=O)=O)cc3)cc2N(C)C1=O | COc1cccc([C@@H]2C[C@]3(C)NC(=O)CCCC[C@@H]3N2CC(=O)NC2CCCCC2)c1 | 0.556989 |
Cc1nc(Nc2nncs2)cc([C@H]2CCCN(C(=O)/C=C/CN(C)C)C2)n1 | COc1cccc(-n2cc(C(=O)O)c3c2[C@@H](c2cccc(F)c2)CC(=O)N3)c1 | 0.671 |
O=C(CN1CCCS1(=O)=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 | O=C1CC[C@@]2(CCCN(c3ccccn3)C2)CN1Cc1ccccn1 | 0.544706 |
COCCn1ccnc1[C@H]1CCCN(c2nc(N)nc3[nH]cnc23)C1 | Cc1nnc(SCC(=O)Nc2ccc3c4c(cccc24)CC3)n1-c1ccccc1 | 0.585263 |
COc1ccc(CN2CCCC[C@@H]2c2cc3nc4c(c(O)n3n2)CN(C(C)=O)CC4)cc1 | COC(=O)c1c(C)[nH]c(C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)c1C | 0.73151 |
Cn1cc(C(=O)N2CCC[C@H](C3(O)CC3)C2)ccc1=O | COc1cccc2c1OC[C@@H](NC(=O)Cc1c(C)nn(-c3ccccc3)c1C)C2 | 0.532397 |
Cc1ccc(C(=O)NCCc2nc3cc(Cl)ccc3s2)c(=O)[nH]1 | CCc1nnsc1C(=O)N1CCO[C@@](COc2cccc(Cl)c2)(CC(=O)N2CCOCC2)C1 | 0.56873 |
N#CCSc1nc2ccc(N3C(=O)[C@@H]4[C@H](C3=O)[C@H]3C=C[C@H]4C3)cc2s1 | O=C(CCn1nc(C(F)(F)F)cc1C1CC1)N1CCN2CCC[C@@H]2C1 | 0.574054 |
CCOc1ccc(-n2c(=S)[nH]c(O)c([C@H]3OC(=O)c4ccccc43)c2=O)cc1 | C[C@H](C(=O)O)n1cc([N+](=O)[O-])c(OCC(F)(F)F)n1 | 0.553736 |
CCn1nc2c(cc1=O)CN(Cc1nnc(C3CC3)o1)CC2 | COc1cccc(C(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)c1OC(F)F | 0.688574 |
Cc1noc(CSc2ccccc2C(=O)OCC(=O)N(C)Cc2ccccc2F)n1 | O=S1(=O)CCO[C@H]2CN(Cc3ccc4c(c3)OCO4)C[C@H]2N1Cc1cccc(F)c1 | 0.597639 |
NCCN1C(=O)CC[C@@H]2CN(C(=O)c3cc4ncccn4n3)CC[C@@H]21 | COc1ccccc1[C@@H](NC(=O)C[C@H]1Sc2ccccc2NC1=O)c1nccn1C | 0.603715 |
Cc1cc([N+](=O)[O-])ccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@H](C(=O)Nc1ccc(Cl)cc1)N1N=CC=C[C@@H]21 | Cn1ncc([N+](=O)[O-])c1C(=O)Nc1c(F)c(F)c(Br)c(F)c1F | 0.699697 |
COc1ccc(-n2cccc2/C=C2\SC(=Nc3ccc(F)cc3)N(C)C2=O)cc1 | COC(=O)c1ccc(OCC(=O)N[C@]2(C)CCS(=O)(=O)C2)c([N+](=O)[O-])c1 | 0.593418 |
CC(=O)c1ccnn1Cc1coc(-c2ccc(F)cc2)n1 | CCOC(=O)c1cc(N(CC)S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl | 0.528217 |
CCOc1ccc2c(c1)OC1(CCN(S(=O)(=O)CC)CC1)CC2=O | COc1ccc(-c2n[nH]c(S[C@H](CC(=O)NCCO)c3cccs3)n2)cc1 | 0.530945 |
Cc1cc(C)n(-c2ccc(C(=O)OCC(=O)N[C@H]3CCCc4ccccc43)cc2)n1 | N#Cc1ccc(Cl)cc1NC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)n1-c1ccccc1 | 0.633994 |
NC(=O)c1cccnc1N1CCN(C(=O)CCSc2ccc3c(c2)OCCO3)CC1 | CC1(C)Cc2noc(N)c2C(C)(C)N1OC(=O)c1ccco1 | 0.625128 |
CN1CCO[C@H]([C@@H](NC(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)c2ccc(Cl)cc2)C1 | O=S1(=O)N[C@@H]2CCCN2c2ccccc21 | 0.544751 |
COC[C@@H](C)n1c(S[C@@H](C)C(=O)Nc2ccc3c(c2)CCC3)nc2ccccc2c1=O | COc1cccc(C2CCN(C(=O)[C@@H](C)n3cncn3)CC2)c1F | 0.571584 |
Nc1ncc(-c2cccc(C(F)(F)F)c2)c([C@@H]2CCCCN2C(=O)CN2C(=O)COCC2=O)n1 | O=c1nc(-c2ccccc2)c2c(=O)nc(-c3ccccc3)c1=2 | 0.545455 |
O=C(NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3)c1cc(F)ccc1F | CCC(=O)N1CCC[C@@H](c2nc(N3CCOCC3)ncc2-c2cccnc2)C1 | 0.631966 |
Fc1ccc2c(c1)[C@@H]1OCC[C@@H]1[C@H](c1cccc(Cl)c1)N2 | O=c1nc([C@H]2CCCCN2Cc2cc(=O)n3cc(Cl)ccc3n2)[nH][nH]1 | 0.614823 |
Cc1nn(-c2ccccc2)nc1C(=O)Nc1ccc(Br)cc1F | CCOc1cccc([C@@H](C)NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 | 0.51071 |
O=C(CSc1nnc(NC2CC2)s1)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 | C[C@@H](COc1ccccc1)NS(=O)(=O)c1nnc(NC(=O)c2ccccc2Cl)s1 | 0.608066 |
CCc1nc(C)cn1S(=O)(=O)c1cccc([N+](=O)[O-])c1 | COc1ccccc1Cc1nc(-c2cccc(OC)c2F)n(CCO)n1 | 0.526927 |
COC(=O)c1ccccc1-n1cccc1[C@@H]1[C@@H](c2ccccn2)NC(=S)N1c1ccc(OC)cc1 | Cc1cnn(C2C[C@H]3CC[C@@H](C2)N3C(=O)C2CCOCC2)c1 | 0.53575 |
CCc1nn2c(nnc3c(=O)n(CCOC)ccc32)c1-c1ccc(Cl)cc1 | Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCn2nccc2C1 | 0.634497 |
O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccc[nH]c1=O | COc1cc(CN(CC(=O)Nc2ccc(C)cc2[N+](=O)[O-])C2CC2)ccc1OC(F)F | 0.55627 |
O=C1COc2cc(O)ccc2-c2cc(O)c(O)cc2C1 | O=C(NC[C@H](O)c1ccccc1)[C@H]1c2ccccc2C(=O)N(C2CCCC2)C12CCCCC2 | 0.527368 |
Cc1cccc(C)c1NC(=O)CN1C(=O)S/C(=C/c2ccc([N+](=O)[O-])cc2)C1=O | Cc1cccc(NC(=O)NC(=O)CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1C | 0.548387 |
Cc1ccc(-n2c(SCC(=O)N3CCNC3=O)nc3ccccc3c2=O)c(C)c1 | O=C1CO[C@]2(CCCN(C(=O)c3cccc4cccnc34)CC2)CN1CCc1ccccc1 | 0.601881 |
C=CCN1C(=O)C(C)(C)COc2cc(NC(=O)CC(C)(C)C)ccc21 | Cc1ccccc1-c1nc2s/c(=C\c3ccccc3F)c(=O)n2n1 | 0.520505 |
O=C1NC2(CCCCCC2)C(=O)N1CCn1c(=O)oc2ccccc21 | COc1cccc(CN(C)C(=O)c2ccc(N(C)S(=O)(=O)c3ccc(C)cc3)cc2)c1 | 0.502155 |
CCn1nc(C)cc1C(=O)N1CCC[C@H]1c1c(C)nn(C)c1OC | Cc1ccc(O)c(CN2CCC[C@@H]2c2c(-c3ccnc(N4CCCC4)n3)cnn2CCO)c1 | 0.815976 |
COc1cccc(-c2csc3ncc(C(=O)Nc4ccc5c(c4)OCCO5)c(=O)n23)c1 | COc1ccc(C2(NCc3cn(CC(=O)N4CCOCC4)c4ccccc34)CCCC2)cc1 | 0.664622 |
COC(=O)C[C@@H](c1ccc(OCCn2cccn2)cc1)c1c(O)ccc2nsnc12 | CSCc1noc(CN2C[C@H]3CC[C@@H](C2)N(CC2CC2)C3=O)n1 | 0.5 |
CCc1cc(N2CC(Oc3ccccc3OC)C2)n2nccc2n1 | C[C@@H](NC(=O)Cc1noc2ccccc12)c1ccc2c(c1)CCCC2 | 0.524784 |
O=C(C[C@H]1CCc2ccccc21)NCc1csc(-c2cnccn2)n1 | NS(=O)(=O)c1ccc(-c2ccc(/C=c3/sc4nc(-c5cccc(Cl)c5)nn4c3=O)o2)cc1 | 0.607325 |
COc1ccc(N2/C(=N\C(=O)CCCC(=O)O)S[C@@H]3CS(=O)(=O)C[C@@H]32)c(OC)c1 | Cc1noc(C)c1CC(=O)N1CCC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 | 0.673824 |
C[C@H]1CCc2sc(C(=O)N3CCC[C@@H](c4cc(CO)[nH]n4)C3)cc2C1 | O=S1(=O)c2ccccc2OCC2(CCN(Cc3ccccn3)CC2)CN1CC1CC1 | 0.633758 |
CO[C@@H]1CCOC[C@H]1NC(=O)c1cc(Cl)c2c(c1)OCCCO2 | C=CCn1c(SCC(=O)Nc2nc3ccccc3s2)nnc1-c1cccs1 | 0.549634 |
O=C1C[C@H](c2ccco2)Cc2c1cnn2-c1nc2ccccc2s1 | Cc1cc(=O)n(CCN2CC[C@@H](CO)[C@@H](O)C2)c(O)n1 | 0.526585 |
CC(C)=C1[C@@H]2CC[C@@H]1[C@H]1C(=O)N(NC(=O)c3ccco3)C(=O)[C@@H]12 | Cc1ccc(C(=O)N2CC[C@]3(CN(CCc4ccccc4)C(=O)O3)C2)cc1NCc1ccccn1 | 0.550218 |
Cc1cc(-c2cnc(N3CCN(C)CC3)nc2[C@@H]2CCCN(Cc3cccnc3)C2)on1 | Cc1cc(C)c2c(N[C@H]3CCCc4sc(C)nc43)ncnc2n1 | 0.73151 |
O=C(NCCSCc1ccccc1F)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 | COc1ccc(-c2nnc(S[C@@H](C)C(=O)N3CCN(Cc4ccccc4)CC3)n2C)cc1 | 0.522173 |
COc1ccccc1NC(=O)c1ccccc1-c1ccccc1 | C=CCOC(=O)C1=C(C)N=c2s/c(=C/C=C/c3ccccc3)c(=O)n2[C@H]1c1cccs1 | 0.520521 |
Cc1cc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cnc1N(C)C | CN(C)C(=O)c1ccc(NC(=O)COC(=O)c2ccc(-c3ccccc3)s2)cc1 | 0.511838 |
O=c1/c(=C\c2ccc(Cl)cc2Cl)sc2nc(-c3ccccc3)nn12 | COCCN1C(=O)[C@@H]2CC[C@H]1CN(Cc1cc(C(F)(F)F)ccc1F)C2 | 0.554255 |
C[C@@H]1CN2C[C@H](NS(=O)(=O)c3ccc(C#N)cc3Cl)C[C@H]2CO1 | Cc1ccc2c(C)nc(NC3=NCN(Cc4ccco4)CN3)nc2c1 | 0.5 |
COc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3c3c(C)ccnn23)cc1 | O=C(CN1CCc2sccc2C1)N1CCC[C@@H](c2ccn[nH]2)C1 | 0.633367 |
CC(=O)Nc1ccc(-c2nnc(SCc3ccc(Cl)cc3)n2C)cc1 | CC(=O)Nc1ccc2c(COC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)cc(=O)oc2c1 | 0.522701 |
O=C(O)[C@]1(C(F)(F)F)CCN(Cc2cc3cnccc3[nH]2)C1 | COc1cccc(-n2c(=O)c3ccccc3n3c(SCC(=O)Nc4cccnc4Cl)nnc23)c1 | 0.579918 |
O=C(NC[C@@](O)(c1ccco1)C1CC1)C(=O)Nc1ccc(OC(F)(F)F)cc1 | O=C(c1ccco1)N1CCC[C@@H](Cc2nnc3ccccn23)C1 | 0.563616 |
O=C(NCc1ccccc1Cl)C(=O)NC[C@@H]1OCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 | CC[C@H]1CCCCN1C(=O)CSc1nnc(-c2ccc(OC)c(OC)c2)o1 | 0.543237 |
CN(Cc1ccccc1N1CCCCC1)C(=O)CCNC(=O)Nc1ccccc1 | CCc1cccc(CC)c1N1C[C@@H](C(=O)OCC(=O)c2ccccc2)CC1=O | 0.525358 |
COc1cc(Cl)cc(CN[C@@H](C)c2cnn(-c3cccc(F)c3)c2C)c1OC | C[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccc(-n2cncn2)cc1 | 0.625422 |
CCS(=O)(=O)N1C[C@@H](C(=O)Nc2ccc(I)cc2C)Oc2ccccc21 | O=C(NCc1ccccc1F)NCc1nnc2n1CCCCC2 | 0.501632 |
O=C(c1cnccn1)N1CCC(c2ccc3cc(-c4cncnc4)cnc3n2)CC1 | CN[C@H]1CCN(C(=O)c2nn(-c3ccccc3C)c3c2CCC3)C1 | 0.634398 |
C[C@@H](Oc1ccccc1)C(=O)Nc1c2c(nn1-c1ccc(Cl)cc1)CS(=O)(=O)C2 | Cc1cc(C(=O)Nc2cnn(Cc3ccc(Br)cc3)c2)c(C)o1 | 0.546306 |
S=C(NCc1ccc2c(c1)OCCO2)Nc1ccc(N2CCCCC2)nc1 | O=C1OCCCN1CCNC(=O)N1CCn2cccc2[C@@H]1c1cccs1 | 0.549626 |
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)N1CCOCC1 | Cc1cccc(C(=O)N2CCN(Cc3cc(=O)n4nc(-c5cccc(Cl)c5)sc4n3)CC2)c1 | 0.634298 |
Cc1ccc(C[C@@H](Nc2ncnc3onc(C)c23)c2ccccn2)cc1 | CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)CNc2nc(Cl)nc3[nH]cnc23)C1 | 0.568837 |
Cc1noc(CN2CCC(Oc3ccccc3C(=O)N3CCCCC3)CC2)n1 | COC(=O)c1cc(CN2CCC(c3noc(C)n3)CC2)c(C)s1 | 0.522209 |
CCN(CC)C(=O)c1c(-c2ccccc2)csc1NC(C)=O | CN(CC(=O)N1CCN(C2CC2)CC1)c1ncnc2nc[nH]c12 | 0.506881 |
COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 | CCS(=O)(=O)N1Cc2ccccc2C[C@@H]1C(=O)Oc1ccc2c3c(c(=O)oc2c1)CCC3 | 0.512927 |
CCNC(=O)[C@H](C)N(Cc1cccc(OC)c1)C(=O)COc1ccc(Cl)cc1 | O=C(N1OC[C@H]2COc3ccc4ccccc4c3[C@@H]21)C12CC3CC(CC(C3)C1)C2 | 0.53348 |
CSc1ccccc1CN1CCC[C@@H](c2ncn[nH]2)C1 | Cc1ncc2c(n1)[C@@]1(CCCN(Cc3[nH]c4ccc(Cl)cc4c3C)C1)CC2 | 0.521739 |
CNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2ccoc2C)n1C | O=C(c1cccc(I)c1)N1CCC[C@H](c2nnc3ccccn23)C1 | 0.546436 |
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)OCC(=O)NCc1ccc(Cl)cc1 | CCCn1c([C@H](C)NC(=O)c2cc(OC)c(OC)c(OC)c2)nc2ccccc21 | 0.556167 |
Cc1cccc2c1N[C@@H](c1ccc([N+](=O)[O-])o1)NC2=O | CCOc1ncccc1C(=O)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 | 0.552916 |
Cc1cccc(CN(C(=O)c2cn(C[C@@H]3CCCNC3)nn2)C2CCCCC2)c1 | Cc1ccc([C@@H](C)NC(=O)[C@H](C)N(c2ccccc2F)S(C)(=O)=O)c(C)c1 | 0.545055 |
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