p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
CC[C@@](NC(=O)c1nc[nH]c2nccc1-2)(C(N)=O)C1CC1 | CSc1nc2n(n1)[C@H](c1cnn(C)c1)C1=C(CCCC1=O)N2 | 0.683 |
CCOc1ccc(CN(C)C(=O)CSc2nnc(-c3ccoc3C)n2C)cc1 | Cc1cc2ncn(C[C@@H](NC(=O)CCS(=O)(=O)C3CCCC3)C3CC3)c2cc1C | 0.541845 |
C[C@H](NCC(=O)Nc1ccccc1C(=O)NC1CC1)c1ccc2c(c1)CCCC2 | N#Cc1ccc2c(c1)CCN[C@@H]2C(=O)N1C[C@H](N)CC2(CCC2)C1 | 0.559322 |
O=C(Nc1ccc2c(c1)OCO2)N1CCN(Cc2cc(=O)n3nc(-c4cccs4)sc3n2)CC1 | CC(C)(C)c1ccc2c(c1)N(S(C)(=O)=O)C[C@@H](C(=O)Nc1ccc(F)cc1F)O2 | 0.710794 |
CC(C)(C)C(=O)N1CCC[C@H](c2cccc(N3CCOC3=O)n2)C1 | CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2C(=O)c1cc2cc(Cl)cc(OC)c2o1 | 0.632568 |
CC(C)[C@H](NC(=O)CSc1nnnn1C1CCCC1)c1ccc2c(c1)OCCCO2 | Cn1c(=O)n2n(c1=O)[C@@H]1C=C[C@H]2[C@]23C=C[C@]12[C@@H]1C=C[C@@H]3c2ccccc21 | 0.672727 |
C=CC(=O)N1CCC(C(=O)N[C@H](c2cccc(OC)c2)c2ccccc2Cl)CC1 | O=C(CSc1nc2ccccc2c(=O)n1CCCO)Nc1nc(-c2cc(F)ccc2F)cs1 | 0.504782 |
O=C(Nc1cc(Cl)ccc1Cl)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 | COc1ccc([C@H]2C(C(=O)c3cccc(OC)c3)=C(O)C(=O)N2c2cc(C)on2)cc1 | 0.673 |
CCC(=O)c1ccc(OCC(=O)Nc2nc(-c3ccccn3)cs2)cc1 | Cc1ccc(NC(=O)COC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1F | 0.532805 |
CCn1cccc1[C@H]1[C@H](c2ccccn2)NC(=S)N1c1ccc(F)cc1 | CCC(=O)Nc1ccc2oc(-c3cc(OC)c(OC)c(OC)c3)nc2c1 | 0.632821 |
COc1ccc([C@@H]2C(C(=O)c3c[nH]c4ccccc34)=C(O)C(=O)N2CCCN(C)C)cc1 | O=c1c2cc(Br)c(Br)n2ccn1Cc1ccc(OC(F)F)cc1 | 0.637666 |
CN(C)C(=O)c1c[nH]nc1[C@@H]1CCCCN1C/C=C/c1ccccn1 | Cc1ccc(C(=O)N(Cc2nccn2C)[C@@H]2CC23CCNCC3)c(F)c1 | 0.524537 |
CCc1ccc(NC(SCC(=O)Nc2cccc(C)c2)=C2C(=O)N(C)C(=O)N(C)C2=O)cc1 | Cc1c(/C=C2/NC(=S)N(c3ccccc3)C2=O)cnn1C | 0.533851 |
Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cc4ccccc4o3)C2=O)c(C)n1[C@@H]1CCS(=O)(=O)C1 | Cc1cc(CC(=O)N2CCC3(CC2)C(=O)Nc2ccccc23)on1 | 0.694611 |
Cc1ccc(C(=O)NC[C@@H]2CCCO2)cc1NS(=O)(=O)c1ccc(Cl)cc1 | CCn1c(SC/C=C/c2ccccc2)nc2sc(C)c(C)c2c1=O | 0.562766 |
CN(Cc1cnn(-c2ccc(F)cc2)c1)c1ncnc2c1CCC2 | COc1cc2c(cc1OC)N(C(=O)[C@H]1CC[C@H](C(=O)O)NC1)CC2 | 0.589041 |
COc1ccc(CNC(=O)c2cc3n(n2)C[C@@H](c2ccc(Cl)cc2)OC3)c(OC)c1 | CN(C)c1ccc(-c2nc3n(c2NC(C)(C)C)CCN(C(=O)c2ccn[nH]2)C3)cc1 | 0.76297 |
O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1nc2ccccc2s1 | C[C@@H]1[C@H](C)N(C(=O)c2cc(C3CC3)nc3ccccc23)CCS1(=O)=O | 0.558761 |
Cc1ccc(-c2ccnc(N3C[C@H]4C[C@H](C3)[C@@H]3CCCC(=O)N3C4)n2)c(C)n1 | CCOc1ccccc1NC(=O)N1CCC[C@@H]1c1cc(C)no1 | 0.56869 |
COc1ccccc1N1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 | COc1ccc(C(=O)NC[C@@H]2CCC[C@@H](O)C2)cc1S(=O)(=O)N(C)C | 0.513173 |
Cn1cc([C@H]2CN(C(=O)c3cc(C4CC4)on3)Cc3ccccc32)cn1 | CCCCn1c(N)c(N(Cc2nc3ccccc3o2)CC(C)C)c(=O)[nH]c1=O | 0.688641 |
Cc1ccc(Cl)cc1-n1c(C)cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)c1C | Cc1ccc(=O)n(CC(=O)N[C@H](C2CCNCC2)[C@H]2C[C@H](O)C2)n1 | 0.545455 |
Cc1cc(C)c2c3c(sc2n1)C(=O)N1CCC[C@@H]1C(=O)N3 | Cc1ccccc1CN(C(=O)COc1cccc2ccccc12)[C@H](C)C(=O)NC(C)(C)C | 0.587449 |
COCCCNC(=O)c1ccccc1NC(=O)[C@H](C)N1c2cccc3cccc(c23)S1(=O)=O | Cc1ccc(NC(=O)[C@H]2CCCN(c3cc(NC4CC4)ncn3)C2)nc1 | 0.535826 |
C[C@H]1CN(Cc2ccccc2S(N)(=O)=O)c2ccccc2NC1=O | CCN(CC)C(=O)c1cc(-c2cnn(CCO)c2)nc2c(C)c(C)ccc12 | 0.554126 |
CCc1cccc(OC[C@@H](O)Cn2c(N3CCN(CCO)CC3)nc3c2c(=O)[nH]c(=O)n3C)c1 | O=C1COc2ccc(C(=O)COC(=O)CCn3nc(-c4cccs4)oc3=O)cc2N1 | 0.721888 |
CC(=O)Nc1cccc(NC(=O)N2CCC[C@H](c3cc(O)nc(C)n3)C2)c1 | Cc1nc(-c2cc(C(=O)N3CCC[C@@H](O)C3)c3ccccn23)cn1Cc1cccnc1 | 0.604339 |
Cc1c(CN2CC[C@H](CNC(=O)c3cnccn3)C2)[nH]c2ccccc12 | CCn1c2cc(C)oc2c2cnn(CC(=O)N3CCCCCC3)c(=O)c21 | 0.572597 |
Cc1nonc1CC(=O)N1CCC(c2nc(N(C)C)ncc2-c2ccccc2F)CC1 | c1ccc(-c2noc(CN(Cc3cccs3)C[C@@H]3CCCO3)n2)cc1 | 0.542354 |
COc1ccc(-c2cc(C(=O)N[C@@H]3CCC[C@@H](C)[C@H]3C)n[nH]2)cc1S(=O)(=O)N1CCOCC1 | COC(=O)c1ccccc1S(=O)(=O)N1CCN(Cc2c(C)nc3cc(C)ccn23)CC1 | 0.688525 |
NNc1nc2c(Br)cc(NC(=O)COc3ccc(Cl)cc3)cc2s1 | COc1ccc(C(=O)C2=C(O)C(=O)N(CC(OC)OC)[C@H]2c2ccccc2)cc1 | 0.604188 |
Cc1ccc(-c2noc(CN3CCO[C@@H](c4nccs4)C3)n2)cc1 | Cc1cccc(N2CCCn3c2nc2c3c(=O)n(Cc3c(F)cccc3Cl)c(=O)n2C)c1 | 0.638086 |
NS(=O)(=O)c1ccc2c(c1)[C@@H](N[C@H]1CC[C@@H](O)C1)CCC2 | Cc1ccccc1[C@@H](CC(C)C)NC[C@@H](CO)Cc1ccco1 | 0.537696 |
C[C@@H]1CC(=O)NC[C@H]1C(=O)N=c1nc[nH]n1-c1ccc(C#N)cc1 | CC(=O)C1=C(O)C(=O)N(C2CCCCC2)[C@@H]1c1ccc(Cl)cc1 | 0.589496 |
O=C(O)[C@@H](Cc1ccccc1)n1c(=S)[nH]c2ccccc2c1=O | O=C(CC[C@@H]1N=C(O)N(CCc2c[nH]c3ccccc23)C1=O)NC[C@H]1CCCN2CCCC[C@H]12 | 0.604255 |
C[C@@H]1Cc2ccccc2N1C(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1 | CCOC(=O)[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 | 0.545359 |
Cc1nc2n(n1)C[C@H](NCc1ccc(N3CCCCC3)cc1)CC2 | Cc1ccc(NC(=O)CSC2=NC(C)(C)N=C2c2ccccc2)c(C)c1 | 0.510591 |
O=C(c1ccc(N2CCCC2)nc1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 | CCOC(=O)N1CCc2c(sc3c2C(O)=N[C@@H](c2cccc(OC)c2O)N3)C1 | 0.549595 |
C[C@H](O)CN(C[C@H](C)O)c1ncnc2c1sc1nc(N3CCCC3)c3c(c12)CC(C)(C)OC3 | Cn1c(SCC(=O)Nc2ccc(Cl)cc2)nc2sc3c(c2c1=O)CCCC3 | 0.843504 |
CCn1c2ccccc2c2cc(/C=N/Nc3ccccc3C(=O)O)ccc21 | CCN(Cc1cccc(F)c1)C(=O)c1ccc2c(c1)S(=O)(=O)N=C1CCCCCN12 | 0.514408 |
O=C(c1ccc(-n2cnnn2)cc1)N1CCCOc2cccc(c2)CC[C@@H]2CCCCN2CC1 | Cc1cc2[nH]c(CN3C[C@@H]4OCCC(=O)N(Cc5ccccc5)[C@H]4C3)cc(=O)n2n1 | 0.604255 |
Cn1cc(CN2C[C@@H]3[C@@H](CNC(=O)c4ccsc4)CO[C@@H]3C2)cn1 | CC(C)c1noc(-c2ccc(NC(=O)N3CCC[C@H]4C(=O)NC[C@@H]43)cc2)n1 | 0.512387 |
C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCn1c(O)nc2ncccc2c1=O | Cc1nn(CCO)cc1CN1CCCC[C@H]1c1nc2ccc(F)cc2[nH]1 | 0.53821 |
COc1cccc([C@H]2CC(=O)NC3=C2C(=O)C[C@H](c2ccc(F)cc2)C3)c1OC | COc1cccc(N(C)C(=O)c2nc(-c3ccn(Cc4ccccn4)c3)n3ccccc23)n1 | 0.747739 |
O=C(CN(C(=O)c1ccccc1Cl)N1C(=O)c2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1 | CCc1ccc(N2C(=O)[C@@H]3[C@@H](N=NN3Cc3nc(-c4ccc(C)cc4)no3)C2=O)cc1 | 0.650565 |
Cc1ccc([C@]23C[C@H]2CN(C(=O)c2cc4cnccc4o2)C3)cc1 | COc1cc(C)c(NC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)cc1OC | 0.549416 |
O=C(O)[C@@H]1CCCN(C(=O)CCc2ncc(-c3ccc(F)cc3)o2)C1 | O=C(Nc1nc2ccc(S(=O)(=O)N3CCOCC3)cc2s1)c1cncc(Br)c1 | 0.516094 |
COC(=O)Cc1c(F)ccc(F)c1F | CN(C)C(=O)NCc1cc(C(F)(F)F)cc(S(C)(=O)=O)c1 | 0.258537 |
CCCn1ncc(C(=O)NCCc2c(F)cccc2Cl)c1C | CCCOCCOC(=O)C1=C(C)NC2=C(C(=O)[C@@H](C(=O)OC)[C@H](C)C2)[C@H]1c1ccc(N(C)C)cc1 | 0.587269 |
C#CCN1C(=O)S/C(=C/c2cccc([N+](=O)[O-])c2O)C1=O | CCCCn1nc(C2CC2)nc1-c1cccs1 | 0.531798 |
COCCN(C)C(=O)c1sc2ncnc(NCC3(c4ccccc4)CCOCC3)c2c1C | O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)Nc1ccc(Oc2ccccc2)cc1 | 0.688391 |
COc1ncc(C(=O)N2CCN(C(=O)N(C)C)[C@@H]3CS(=O)(=O)C[C@@H]32)cn1 | CN(C)C(=O)c1ccc([C@@H]2CCCN2C(=O)c2cccc3c2OCC3)s1 | 0.602524 |
CCc1ccc(C(=O)N2CCc3c(sc4ncnc(N)c34)C2)cc1 | Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1C[C@@H](O)CO1 | 0.61194 |
CCOc1ccc([C@H]2Nc3ccccc3C(=O)N2C[C@@H]2CCCO2)cc1OC | CO[C@H]1CCN([C@H]2CCC[C@H]2N(C)C(=O)c2ocnc2C2CC2)C1 | 0.621679 |
CCOc1ccc(Sc2cc(C)nc(Oc3ccc(=O)n(C)n3)n2)nn1 | CC(=O)NCCC(=O)[C@H](C#N)C(=O)c1c[nH]c2cc(Cl)ccc12 | 0.505543 |
CNC(=O)c1ccc(/C=C2/C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)c3ccccc32)cc1 | CC1(C)C[C@]1(CNC(=O)NC1(C(N)=O)CCCC1)c1ccccc1 | 0.506037 |
O=C(NCc1cccnc1)c1ccc2n1CCN(C(=O)Cc1ccccc1)CC2 | COc1ccc(-c2cc3nc([C@@H](C)NC(=O)c4ccccc4F)nn3cn2)cc1 | 0.623126 |
COc1ccccc1CN1C(=O)[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C1=O | COCCn1c(C(=O)NC[C@@H]2CCCO2)nc2ccccc2c1=O | 0.609208 |
COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1cc2c(cc1Br)OCO2 | O=C1NC[C@H](C(=O)N(Cc2cccc(Br)c2)C2CC2)N1 | 0.508439 |
COCCCN1C(=O)C(O)=C(C(=O)c2ccc(S(=O)(=O)N(C)C)cc2)[C@H]1c1ccc(C)cc1 | CO[C@H]1Cc2ccccc2N(C(=O)Cc2cnn(C)c2)C1 | 0.628272 |
COCCN1C(=O)N(C2CCOCC2)[C@H]2CC[C@@H](c3cccnc3)[C@H]21 | C=CCn1c(SCC(N)=O)nc2c1c(=O)[nH]c(=O)n2C | 0.593521 |
O=C(c1c(N2CCOCC2)noc1-c1ccccc1)N1CC(N2CCCCC2)C1 | CCn1ncc(S(=O)(=O)NCc2cn(-c3ccccc3)nc2-c2ccccc2)c1C | 0.668041 |
Cc1ccc2c(c1)c1c3n2CCN(S(=O)(=O)c2cc4oc(=O)n(C)c4cc2Cl)[C@@H]3CCC1 | Cn1cc(-c2cn(CCS(=O)(=O)C3CCCCC3)nn2)cn1 | 0.511905 |
O=C(CSc1nnc(-c2cccs2)o1)N[C@H](c1ccccc1)c1cccs1 | CCn1c(CN2CCCC2)nnc1C1CCN(C(=O)c2cc(C)no2)CC1 | 0.560557 |
Cc1ccccc1C(=O)Nc1ccc(N2N=C(C3CC3)CC2=O)nc1 | CCOCCc1nc(CC(C)C)nn1-c1cccc2cccnc12 | 0.574132 |
C[C@@]1(CNC(=O)c2ccc(OCC(=O)O)cc2)OCCc2sccc21 | Cc1oc2c(c1C(=O)N(C)[C@@H]1CC[C@@H](O)[C@@H]1O)CCCC2 | 0.616773 |
Cc1ccc(-c2noc(Cc3nnc(-c4ccc(C)c(F)c4)o3)n2)cc1C | Cc1ccc(F)c(NC(=O)CCc2nc(-c3ccccc3)no2)c1 | 0.561905 |
COc1ccc(N(CC(=O)Nc2ccc3c(c2)oc2ccccc23)S(C)(=O)=O)cc1OC | CC(C)[C@@H]1[C@H](C(C)C)CN1c1c(C#N)c(=O)n(C)c(=O)n1C | 0.579665 |
CC(C)c1nc(C[C@H]2NC(=O)c3ccccc32)n(-c2ccccn2)n1 | Cc1ccccc1N1C[C@H](Cc2ccccc2)N(C(=O)C2CC2)CC1=O | 0.58682 |
CCCCN1C(=O)/C(=C\c2cccs2)NC1=S | Cc1ccc([C@@H]2c3c(-c4c(C)cc(C)cc4O)n[nH]c3C(=O)N2CCCO)cc1 | 0.532323 |
Cc1ccc(COc2c(C=NN3C(=O)[C@@H]4[C@H](C3=O)[C@H]3C=C[C@H]4C3)cc(Cl)cc2[N+](=O)[O-])cc1 | Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1nn(-c2cccc(C(F)(F)F)c2)c(C)cc1=O | 0.766865 |
COc1ccc(C(=O)N2CCNC(=O)[C@@H]2CCO)c(OC)c1OC | C[C@@H]1CC2(CO1)CC(NC(=O)C(=O)NC[C@]1(c3ccccc3)COCCO1)C2 | 0.533408 |
CCOC(=O)[C@]1(C#N)[C@H]2C=C[C@@H](C2)[C@@H]1c1ccc(N(C)C)c(Br)c1 | CN(Cc1nc(-c2ccccc2)no1)C(=O)c1ccccc1OCc1ccccc1 | 0.532839 |
Cc1nn(C)cc1CN1CCC(c2nnc(CN3CCCCC3)n2C)CC1 | Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)c3cc(C4CC4)[nH]n3)no2)cn1 | 0.587662 |
Cc1ccc(C)c(OC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c1C | CC(C)c1nc(CN(C)C(=O)Nc2ccc3c(c2)nnn3C)no1 | 0.544662 |
CCN(Cc1ccc2c(c1)OCO2)C(=O)c1cc2ccccc2oc1=O | Cn1nc(C(=O)Nc2ccccc2)c2c1CCN(Cc1ccc(C(=O)O)cc1)C2 | 0.583244 |
CC[C@H]1COCc2nnc(-c3c(C)nc4ccccn34)n21 | O=C(c1n[nH]c2ccccc12)N1CCCn2nc([C@H](O)C3CC3)cc2C1 | 0.7334 |
CN(C)/C=N/C(=O)C1=NO[C@@H](CNc2ncc(C(F)(F)F)cc2Cl)C1 | Cc1cc(C)n2nc(C(=O)N3CCC(c4nc(C)c(C)c(N5CCOCC5)n4)CC3)cc2n1 | 0.602725 |
CC[C@H](C)OC(=O)[C@H]1CC=CC[C@H]1C(=O)Nc1cc(C(=O)O)ccc1C | COc1ccc(N2CCN(C3=N[C@@H](c4cccnc4)n4c(nc(C)cc4=O)N3)CC2)cc1 | 0.541453 |
O=C(CSc1ncc(-c2ccccc2)nn1)Nc1cccc2ccccc12 | CCc1noc(CC)c1CNC(=O)c1c2c(nn1CC)[C@H](C)O[C@H](C)C2 | 0.525988 |
COc1cccc2c1OC[C@H](CNC(=O)c1cccc(-n3nnnc3C)c1)C2 | COc1ccc(-c2noc(CCCCCNC(=O)c3ccccc3[S@@](C)=O)n2)cc1 | 0.581215 |
COC(=O)Cn1c(=O)c2c(nc3n2C[C@@H](C)CN3c2ccc(Cl)cc2)n(C)c1=O | Cc1ccccc1-n1nc(-c2ccccc2)cc1N | 0.569138 |
CC(C)CCN1C(=O)c2ccc(C(=O)OCC(=O)NCc3ccccc3Cl)cc2C1=O | C#CCSCCn1c(-c2cccnc2)nnc1N1CC[C@H](CN2CCCCC2)C1 | 0.506908 |
CCCCNC(=O)CSc1nnc(C)n1-c1ccc(OC)cc1 | Cn1cc(CN2C[C@@H]3Cn4c(nnc4C(=O)NC4CC4)C[C@H]3C2)cn1 | 0.509372 |
CCCCCOC(=O)[C@H]1[C@H]2C(=O)N(c3ccc(C)cc3)C[C@]23C=C[C@H]1O3 | COCCNC(=O)c1nc(-c2ccc(F)cc2)n(-c2cccc(C)c2)n1 | 0.643514 |
O=C(CSc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)NCc1ccc(Cl)cc1 | COC1(CNS(=O)(=O)c2c(C)nn(C(C)C)c2C)CCSCC1 | 0.557342 |
Cc1nn(C)c(C)c1NC(=O)c1cccc(CN2C[C@H]3CC[C@@H](C2)N3)c1 | C[C@@H](NC(=O)c1ccc2nc(-c3ccc(F)cc3)cn2c1)c1nnc(N)s1 | 0.532453 |
Cc1cccn(CC(=O)N[C@H](c2cccc(F)c2)c2nccn2C)c1=O | NC(=O)C1CCN(C2=NC(=O)/C(=C\C3=Cc4ccccc4OC3)S2)CC1 | 0.536638 |
COc1ccccc1C1=N/C(=C\c2ccc(OS(=O)(=O)c3ccc(F)cc3)cc2)C(=O)O1 | CN(C)[C@](C(=O)O)(c1ccccc1)[C@@H]1CCS(=O)(=O)C1 | 0.590387 |
CCOC(=O)N1CCN(c2ncnc3c2oc2nc(CC(C)C)c4c(c23)CCCC4)CC1 | Cc1cc2c(nc1-c1ccccc1)-c1ccccc1C2=O | 0.654582 |
O=C(N1CCO[C@H](C(F)F)C1)C1(c2ccc(Cl)cc2)CCOCC1 | Cc1nc(N2CCC[C@@H](N[C@@H]3CCc4ccccc43)CC2)nc2cc(S(C)(=O)=O)ccc12 | 0.538206 |
CCN(Cc1ccc2c(c1)OCCO2)C(=O)c1cccc(NC(=O)CCn2ccnc2)c1 | COc1ccc(-c2c(NC(=O)c3ccc([N+](=O)[O-])cc3)n(-c3ccc(C)c(C)c3)nc(C)c2=O)cc1 | 0.591753 |
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(C(=O)NCC(C)(C)CN(C)C)CC1 | CNc1nc([C@@H]2CCCCN2C(=O)Cc2ccc(F)cc2)nc2c1CN(C)CC2 | 0.534247 |
CCOC(=O)C1=NN[C@]2(C)C(=O)N(c3ccc(Br)cc3)C(=O)[C@H]12 | Cc1ccc(O)c(CN[C@@H](c2nc(C(C)C)no2)C2CCOCC2)n1 | 0.625641 |
Cc1nc(N2C[C@H]3CN(c4ccc(C(F)(F)F)nn4)C[C@H]3C2)nc(O)c1F | COCCc1nnc2sc(-c3cccc(Cl)c3)nn12 | 0.506173 |
COc1cc([C@H]2SCC(=O)N2c2ccc(C)cc2)ccc1OC(=O)C[C@H]1SC(=O)NC1=O | Cc1nc2ccc(NC(=O)c3cccnc3N3CCOCC3)cc2o1 | 0.626569 |
COc1ccccc1CC(=O)N1C[C@@H]2CN(c3ccc4nnc(C)n4n3)C[C@@H]2C1 | CCn1ncc(C2=NO[C@@H](C(=O)Nc3ccc(C)cc3)C2)c1C | 0.588735 |
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1CC(=O)Nc1ccccc1C(=O)NC1CC1 | Cn1cc([C@H]2CCCN2C(=O)c2ccc(F)c(F)c2)cn1 | 0.522042 |
Nn1c(SCc2ccccc2)nc2ccc(Br)cc2c1=O | NC(=O)C1CCN(C(=O)CSc2nc3ccsc3c(=O)n2Cc2ccco2)CC1 | 0.569579 |
O=C(Oc1ccccc1/C=c1\sc2nc3ccccc3n2c1=O)c1cccc2ccccc12 | CCOC(=O)CCn1c(=O)c2c(nc3n(-c4cc(OC)ccc4OC)c(C)c(C)n23)n(C)c1=O | 0.780632 |
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