p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
C[C@]1(C(=O)O)CCN(C(=O)[C@H]2C[C@H]2c2ccc(F)c(F)c2)C1 | Cc1ccc(Cl)cc1S(=O)(=O)N1CCC2(CC1)N=C(c1ccc(C(C)(C)C)cc1)C(=O)N2 | 0.524229 |
Cc1ccc(N2C(=O)CN(c3c(C)cccc3C)C(=O)[C@H]2c2ccco2)cc1 | Cc1ccc(C(=O)NC(=S)Nc2sc3c(c2C#N)CC[C@H](C)C3)cc1[N+](=O)[O-] | 0.70333 |
c1coc(CN2CCOC[C@]3(C[C@H](CN4CCCC4)CO3)C2)c1 | COCc1nc2n(n1)C[C@@H](NC(=O)c1cccnc1OCC(F)(F)F)CC2 | 0.507027 |
CCCCn1c(=O)[nH]c(=O)c2c1nc(-c1cc(OC)c(OC)cc1OC)n2C | COc1ccc(C(=O)N/C(=C\c2ccco2)C(=O)NC2CCCCCC2)cc1OC | 0.601221 |
C[C@@H]1CCCN(c2nc3c(c(=O)[nH]2)CN(C(=O)Cc2ccc4[nH]cnc4c2)CC3)C1 | Cc1cccc(OCC(=O)Nc2ccc3c(c2)nc(CCN2CCCCC2)n3C)c1 | 0.612267 |
O=C(c1cnc2ccccc2c1)N1CCC(c2ccnc3ccnn23)CC1 | CC[C@H](C)c1ccc(O)c(NC(=O)COc2ccc(Cl)cc2-n2cnnc2)c1 | 0.545847 |
C[C@H]1C[C@H]1c1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)o1 | CCCN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1 | 0.51462 |
C[C@@H]1CS(=O)(=O)CCN1C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 | NC(=O)C[C@]1(COc2ccc(F)cc2)CN(C(=O)c2csc(N)n2)CCO1 | 0.59445 |
Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)NC1CCCC1 | O=C(N[C@@H]1CC[S@](=O)C1)c1cccc(-n2nccc2-c2ccccc2)c1 | 0.592 |
CCCC(=O)Nc1ccc(Cl)c(NC(=S)NC(=O)c2ccc(OC)c(OC)c2)c1 | CO[C@H]1COC[C@@H]1NS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2 | 0.540023 |
Cc1c(N[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)C(Cl)(Cl)Cl)c(=O)n(-c2ccccc2)n1C | O=C1NC(=O)[C@@H](c2ccc(NC(=O)C(C3CC3)C3CC3)cc2)N1 | 0.512712 |
Cn1cnc2cc(C(=O)N3C[C@@H](O)[C@H](n4ccnn4)C3)ccc21 | Cc1cccn2cc(-c3ccc(NC(=O)CNC(=O)c4ccccc4)cc3)nc12 | 0.533623 |
Cc1ccc2nc(C(=O)NCc3nc(C(F)(F)F)n[nH]3)c(F)n2c1 | CN(C)C1(CNC(=O)CCCN2C(=O)c3cccc4cccc(c34)C2=O)CCCCCC1 | 0.505039 |
O=C(Cc1c[nH]c(=O)[nH]c1=O)Nc1ncc(Cc2ccc(F)cc2)s1 | Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)OCC(=O)Nc1sccc1C(N)=O | 0.541401 |
Cn1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)cn1 | O=C(Nc1ccccc1-n1cncn1)c1ccc(=O)n(CCOc2ccccc2)n1 | 0.505085 |
CC1=C(C(=O)N2CCOCC2)[C@H](c2cc(Br)ccc2F)C2=C(CC(C)(C)CC2=O)N1 | CC[C@@H](C(=O)NC)N(Cc1ccc(F)cc1)C(=O)CSCc1cccc(Cl)c1 | 0.524302 |
COCCCN1CC2(CCC1=O)CCN(Cc1cc(C(C)C)no1)CC2 | Cc1cn([C@@H]2CN(C(=O)[C@@H](N)CCCCN)CC[C@@]2(C)O)c(O)nc1=O | 0.50348 |
Cc1cc(O)c([C@H]2OC(=O)c3ccccc32)c(=O)n1Cc1ccccn1 | Cc1nn(CN2C[C@H](C)O[C@@H](C)C2)c(=S)n1Cc1ccccc1 | 0.582383 |
COc1ccc(F)cc1C(=O)C1=C(O)C(=O)N(CCN2CCOCC2)[C@H]1c1ccccn1 | CC(C)c1noc2ncc(C(=O)Nc3nc4c(s3)CCCC4)cc12 | 0.771429 |
O=C(NC1(c2nnc3n2CCCC3)CCC1)[C@H]1CC[C@H]1c1ccc(F)cc1 | CCOc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCN(Cc3ccccc3)CC2)cc1 | 0.534392 |
O=C(NCc1nnc(C2CC2)n1C1CC1)c1cc(Cl)cc(C(F)(F)F)c1 | COc1ccc(-c2ccc([C@@H](C)NC(C)=O)cc2)c2ccc(C)nc12 | 0.503982 |
CO[C@H](C)[C@@H](C)NC(=O)NCc1cnc(N2CCOCC2)c(F)c1 | CCOC(=O)COc1c(Cl)cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)cc1OCC | 0.513514 |
c1coc(CN2Cc3ccnn3[C@H](CCOCC3CCOCC3)C2)c1 | C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)N2CC[C@]3(CC(=O)c4ccccc4O3)C2)C1 | 0.632278 |
COC(=O)CN1CCN(c2nccc(C3CCCC3)n2)[C@H](C)C1=O | CC[C@H](Oc1cccc(C)c1)C(=O)N(CC)Cc1nc(-c2cccs2)no1 | 0.525796 |
C=CCN(C)C(=O)[C@@H](C)[C@@H]1CC[C@@]2(C)Cc3sc(NCCCC)nc3[C@@H](C)[C@@H]2[C@H]1O | Cc1nc2ccc(NS(=O)(=O)c3ccc(NS(C)(=O)=O)cc3)cc2s1 | 0.512848 |
CC(C)CCn1c(CN2C[C@@H]3CNC(=O)[C@@H]3C2)nc2ccccc21 | O=C1[C@@H](Cc2nc3ccccc3o2)n2nc(-c3ccccc3)nc2[C@@H]2CCCN12 | 0.626385 |
COc1ccc(CCNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 | CCOc1ccc(C(=O)Nc2ccccc2C(=O)NCc2cccnc2)cc1OCC | 0.60688 |
COc1ccc(C(=O)c2oc3ccccc3c2NC(=O)c2ccccc2)cc1 | CC[C@H](C)n1ncc(C(=O)NCC2(C(=O)O)CCOCC2)c1C1CC1 | 0.597077 |
NC1=N[C@H](c2ccccc2[N+](=O)[O-])N2C(=N1)N=C(O)c1ccccc12 | COc1ccc(-c2onc(N3CCCN(C(=O)C4CCC4)CC3)c2C(=O)O)cc1 | 0.711268 |
O=C(Cc1cnn(-c2ccccc2)c1)Nc1nc2ccccc2s1 | CC[C@H](C(=O)NCc1nn(C)c2cccc(Cl)c12)n1cccn1 | 0.534557 |
Cc1nn(-c2ccccc2)c(C)c1[C@H]1COCCN1S(=O)(=O)c1cnn(C)c1 | Cc1ccnc2nc(C(=O)Nc3ccccc3SCC(F)(F)F)nn12 | 0.613428 |
Cn1nc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)c2ccccc2c1=O | Cc1nocc1S(=O)(=O)N1CCC[C@H](c2nnc3ccccn23)C1 | 0.668024 |
CC1=C2[C@H](CCS2(=O)=O)C2=C(C1)C(=O)c1ccccc1C2=O | Cn1cc(S(=O)(=O)N2CCC[C@@H](C(=O)N3CCN(Cc4ccccc4Cl)CC3)C2)cn1 | 0.606061 |
O=C1CC(c2ccccc2)=NN1c1cc(Cl)ccc1Cl | CC(=O)c1ccc(NC(=O)CSc2ncnc3c2nnn3-c2cccc(Cl)c2)cc1 | 0.590812 |
CC(C)(C)OC(=O)N[C@H]1C[C@H](NC(=O)c2ocnc2C2CC2)C1(C)C | CNC(=O)c1csc2nc(-c3ccc(C(F)(F)F)cc3)cn12 | 0.50216 |
O=[N+]([O-])c1ccc2nc(NC[C@H]3CCCO[C@@H]3c3ccccc3)ccc2c1 | Cc1cc(C(=O)N2C[C@@H](C)c3ccccc32)nn1-c1cccc(C(F)(F)F)c1 | 0.601246 |
Cn1cccc1C(=O)N1CCC[C@H](Cc2[nH]ncc2S(C)(=O)=O)C1 | CC(C)CN1C[C@@H]2[C@@H](NC(=O)c3ccco3)CCS(=O)(=O)[C@@H]2C1 | 0.563736 |
COC(=O)C[C@H](c1cc2ccccc2nc1O)c1c(O)cc(C)n(C)c1=O | COCCNC(=O)[C@H]1C[C@H]2CC[C@H]1C[C@@]21NC(=O)c2ccccc2O1 | 0.645621 |
CCOC(=O)N1CCC[C@H](C(=O)Oc2ccc(C#N)cc2OC)C1 | CC(=O)N1CCC[C@H]2N(C(=O)c3cccnc3-c3scnc3C)CCC[C@@]21C | 0.531483 |
CCCOc1cccc(C(=O)N(Cc2ccccc2F)[C@@H]2CCS(=O)(=O)C2)c1 | COc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)cc1 | 0.541619 |
Cc1cc(=NC(=O)C(=O)NC[C@]2(O)CSCc3ccccc32)[nH]o1 | CCS(=O)(=O)N1CCCc2cc(C(=O)Nc3ccc(OC)c(OC)c3)ccc21 | 0.594049 |
COc1ccc(N2CCN(C(=O)c3ccccc3SCc3ccccc3)CC2)c([N+](=O)[O-])c1 | Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@@H]2C1=O | 0.575112 |
COC(=O)C1=C(C)Nc2c(c(=O)n(C)c(=O)n2C)[C@H]1c1ccc(O)cc1 | CC(=O)c1ccc(OCC(=O)Nc2c(-c3ccccc3)nc3sccn23)cc1 | 0.738569 |
Cc1[nH]c([C@H]2CC(=O)N(C(C)C)C2)nc1-c1ccccc1F | O=C(NCc1ccco1)C(=O)NC[C@H](c1cccs1)n1cccn1 | 0.517241 |
C/C=C/C(=O)N1CCC(c2nc(O)c3nnn(Cc4ccc(F)cc4)c3n2)CC1 | Cc1ccsc1CN(C)C(=O)C1(C[C@H]2CC(c3ccc(F)cc3)=NO2)CCOCC1 | 0.613613 |
CCN(CC)CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 | Cc1nnc([C@@H]2Cc3ccccc3CN2C(=O)[C@H](C)c2cccnc2)o1 | 0.532051 |
CCOc1ccc(-n2c(SCC(=O)Nc3ncccn3)nnc2-c2ccccc2OC)cc1 | C[C@]1(c2cccnc2)OC(=O)N2CCc3ccccc3[C@]21C | 0.744554 |
COc1ccc(NC(=O)COC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1OC | CC[C@@H](NC(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C)c1nc(C)no1 | 0.651187 |
C[C@@H]1CCc2nc3sc4c(c3c(C(F)(F)F)c2C1)NC(=O)[C@H]1CCCN1C4=O | COc1ccc(CN(C)C(=O)CSc2nnc(-c3ccccc3Br)o2)cc1OC | 0.659722 |
CC1(C)C[C@@H](n2[nH]c(=O)c3c2N=C(O)CS[C@H]3c2ccc([N+](=O)[O-])cc2)CCO1 | CCOc1ccc(NC(=O)N2CC(c3nc(-c4cccc(C(F)(F)F)c4)no3)C2)cc1 | 0.623085 |
Cc1cc(C(=O)COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)n1C[C@H]1CCCO1 | C[C@H]1CCc2nc(NC(=O)c3ccc(N4CCCCC4)c([N+](=O)[O-])c3)sc2C1 | 0.680166 |
Cc1ccc(NC(=O)[C@@H]2NCCOc3ccccc32)cn1 | O=C(NC[C@@H]1COc2ccccc2O1)c1cc2c(s1)CCOC21CCNCC1 | 0.584107 |
O=C(N[C@@H](Cn1ccnc1)c1ccccc1)c1cc(=O)[nH]c2ccccc12 | N#Cc1ccc(Cl)cc1N1C(=O)[C@@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C1=O | 0.562963 |
Cc1ccc(C)c(-n2nc(C(=O)NCCO)nc2-c2ccc(Br)cc2)c1 | Cc1cc(=O)c(O)c(C2(CC(=O)NC[C@@H](C)O)CCCCC2)o1 | 0.55804 |
C(=N/c1nc2ccccc2n1CCN1CCCCC1)\c1ccc2c(c1)OCO2 | CCCCn1c(CN(C)Cc2nc(C)c[nH]2)cnc1S(=O)(=O)CCCC(C)C | 0.545952 |
COc1ccc(C(=O)Nc2cc(OC)ccc2-n2cnnn2)cc1 | CCCCn1c(SCC(=O)Nc2c(C)cc(C)cc2C)nc2ccsc2c1=O | 0.541977 |
CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)[C@@H]2SC1 | Cc1n[nH]c(CNC(=O)c2ccc([C@@H]3CCCN3C(=O)C3CCOCC3)s2)n1 | 0.676 |
CCN(CC)C(=O)c1ccccc1NC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1 | CCCC[C@@H]1CN(C(=O)c2n[nH]c(-n3cnnc3)n2)C[C@H](C(C)C)O1 | 0.53132 |
CN1CCC(Oc2ccc(NC(=O)[C@H]3CCCN3S(=O)(=O)c3ccc(Cl)cc3)cc2)CC1 | O=C1CCc2cc(CC(=O)Nc3n[nH]c4c3COCC4)ccc2N1 | 0.556624 |
COc1ccc(-n2nnnc2C2(N3C[C@@]45C=C[C@H](O4)[C@H](C(=O)O)[C@@H]5C3=O)CCCCC2)cc1 | CCOC(=O)C1=C2NCCN2C2=C(CCCC2)[C@@H]1c1ccccc1 | 0.794846 |
O=C(/C=C/c1csc(Br)c1)c1cnnn1-c1ccccc1 | O=C(N[C@@H]1C[C@@H]2CNC[C@H]21)c1nccnc1-c1nc2ccccc2s1 | 0.530398 |
CCOc1cc(Cl)c(/C=C2/NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OCC | Cc1noc(C)c1C(=O)OCc1nc2ccc(Cl)cc2n1CCO | 0.597872 |
Cn1c(=O)c(C(=O)/C=C/Cc2ccccc2)c(O)c2ccccc21 | Cc1c(CNC(=O)N(C)Cc2noc3c2CCCC3)cnn1C | 0.552966 |
C[C@H](O)CCNc1nnc2c3ccccc3n(C)c2n1 | COc1ccc(-c2cnc3n2CCNC32CCN(C(=O)N(C)C)CC2)cc1 | 0.612266 |
Cc1cc(CNc2nc(-c3ccc(C)s3)cc(C(F)(F)F)n2)n(C)n1 | Cn1cc(S(=O)(=O)Nc2ccc(OCc3nccn3C)cc2)nc1Cl | 0.501647 |
CN1CC[C@@](C)(CNC(=O)CCc2nnc(C3(c4ccc(Cl)cc4)CCC3)o2)C1 | COc1ccc(NS(=O)(=O)c2ccc3c(c2)sc(=O)n3Cc2ccccc2)c(OC)c1 | 0.597917 |
O=C(c1cnc2c[nH]nc2c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 | Cc1nnc(-c2ccc(C(=O)N3CC[C@@H]4[C@H](CCC(=O)N4C4CC4)C3)cc2)o1 | 0.590643 |
CC(=O)N1CCC[C@H](CNC(=O)N2CCOc3ccc(CO)cc3C2)C1 | CCc1noc(-c2cn(C3CCN(C(=O)c4ccc(C)cc4)CC3)nn2)n1 | 0.5213 |
CN1C(=O)Cc2cc(C3=NN=C(NC4CC4)SC3)ccc21 | Cc1ccc(-n2c(Cc3cccc4ccccc34)nnc2S[C@@H](C)C(N)=O)c(C)c1 | 0.557097 |
O=C(Cn1cnc2sc3c(c2c1=O)CCC3)N1CCCc2ccccc21 | C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](C)OC(=O)c1ccc2c(c1)OCCO2 | 0.525304 |
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC([C@@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)CC2)c1 | COc1ccc(C(=O)N2CCC[C@H]2c2cccs2)cc1OC | 0.52413 |
O=c1cc(N2CCC(O)CC2)cnn1[C@@H]1CCCN(Cc2cnn3ccccc23)C1 | C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)[C@@H]1COCCN1 | 0.521413 |
CCCc1ncncc1C(=O)N[C@@H]1[C@H]2CCO[C@H]2[C@H]1COC | C#CC[C@]1(O)C[C@@H](C(=O)N(C)[C@H](C)CNC(=O)c2cc(-c3ccccn3)[nH]n2)C1 | 0.519084 |
CCN1CCN(C(=O)c2ccc(N(Cc3ccccc3)S(C)(=O)=O)cc2)CC1 | Cc1cc(C)cc(N2CCCn3c2nc2c3c(=O)n(CCc3ccccc3)c(=O)n2C)c1 | 0.522843 |
CC(=O)c1c(C)cc(C)c(COC(=O)c2ccc3nc(C)c(C)nc3c2)c1C | Cc1cc(C)cc(C(=O)Nc2cc(-n3c(C)nc4ccccc4c3=O)ccc2F)c1 | 0.569857 |
O=C(Cn1nc2n(c(=O)c1=O)CCN2c1ccc(F)cc1)Nc1ccc2c(c1)OCCO2 | C[C@]1(C(=O)O)Oc2ccc(Cl)cc2NC1=O | 0.567876 |
Cc1cc(CC(=O)N2CCC[C@@H](c3nccn3CCN(C)C)C2)on1 | COC(=O)CSc1nc2sc3c(c2c(=O)n1-c1ccc(C)cc1)CCN(Cc1ccccc1)C3 | 0.622851 |
CC[N+](C)(CC)CCOC(=O)c1nn(C)c(=O)c2ccccc12 | COc1cc(NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccccc2)cc(OC)c1OC | 0.531284 |
COc1ccc(S(=O)(=O)N2CCCC2)cc1CCC(=O)N[C@@H]1CCCc2ccccc21 | O=C(NCc1ccc(-c2nc3ncccc3o2)cc1)c1ccc2ccccc2c1 | 0.504983 |
O=C1c2ccccc2-c2nn(C[C@@H](O)COCc3cccs3)c3cccc1c23 | CC[C@@H](C(=O)NCCCc1ccc(OC)cc1)N(c1cc(C)ccc1C)S(C)(=O)=O | 0.647533 |
Cc1ccc(C(=O)N2CCCC[C@H]3[C@@H]2[C@H](c2ccccc2)CN3C)cn1 | Cc1c([C@H](C)NC(=O)CN2CCOC2=O)cnn1-c1ccc(F)cc1F | 0.596013 |
O=C(CSc1nnnn1-c1cccc(F)c1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 | CNc1ncccc1CN1CCC[C@H]1c1cccc(Cc2ccccc2F)n1 | 0.553533 |
O=C(Nc1nccs1)c1cccc(CN2CCC[C@@H]2c2ccccn2)c1 | CCN(CC)CCCN1C(=O)C(O)=C(C(=O)c2ccc3c(c2)C[C@@H](C)O3)[C@@H]1c1ccc([N+](=O)[O-])cc1 | 0.622816 |
CC1(C)Cc2nc(N3CCCC3)ncc2[C@@H](NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1 | O=C(c1ccc(C(F)(F)F)cc1)N1C[C@@H]2COc3ccccc3C[C@]2(CO)C1 | 0.615795 |
COc1ccc(OC)c(/C=C2\SC(=O)N(CC(=O)N[C@@H]3CSC[C@H]3O)C2=O)c1 | CC[C@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1nc2c(s1)CCCCC2 | 0.604701 |
COC(=O)[C@H]1SCCN1S(=O)(=O)c1cc(C)oc1C | CCOC(=O)c1c(NC(=O)COc2ccc(F)cc2F)sc2c1CC[C@@H](CC)C2 | 0.642784 |
COc1ccc(NC(=O)[C@H]2C[C@H](C(C)C)N[C@]23C(=O)Nc2c(Cl)cc(C)cc23)cc1 | COc1cc(OC)cc(C(=O)N[C@H](C(=O)NCc2cccc(C(F)(F)F)c2)C(C)C)c1 | 0.539634 |
CCCCn1c(N)c(N(Cc2ccco2)C(=O)CCC)c(=O)[nH]c1=O | CC(C)(C)[C@H]1OCC[C@@H]1c1nnc([C@@H]2C[C@@H]2c2cccnc2)o1 | 0.627835 |
COC(=O)C1=NN[C@H]2C(=O)N(c3cc(Cl)ccc3C)C(=O)[C@H]12 | CCn1nc(C(=O)N2CCc3ncncc3C2)c2c1[C@H](C)O[C@H](C)C2 | 0.761858 |
Cc1noc(C)c1CCC(=O)N1CCC(n2nc(C3CC3)ccc2=O)CC1 | Cc1ccc(Cl)cc1N[C]1NC(=O)/C(=C/c2ccc(OCC(N)=O)c(Br)c2)S1 | 0.531049 |
COc1cc(/C=C2/C(=O)NN(c3cccc(Cl)c3)C2=O)ccc1OCc1ccccc1 | C[C@@H]1OCC[C@H]1C(=O)/N=c1/sc2ccccc2n1C | 0.511803 |
O=C1CC[C@@]2(C(=O)NOCc3ccccc3)Sc3ccccc3N12 | COC(=O)Cc1cc(OC)c([N+](=O)[O-])cc1[N+](=O)[O-] | 0.5212 |
Cc1ccccc1-n1nccc1[C@H]1OCC[C@@H]1/C(O)=N/Cc1cccnc1 | Cc1cc(C(C)(C)C)cc(C)c1CS(=O)(=O)CC(=O)Nc1ccc2c(c1)OCO2 | 0.521053 |
Cn1c2ccccc2c2ncn(CCO)c(=O)c21 | COC(=O)C1(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)CCCCC1 | 0.526596 |
O=C(c1cn2ccsc2n1)N1CCO[C@H]2C[C@H](CO)C[C@@H]21 | Cc1cc(CN2C[C@@H]3CN(C(=O)c4cnn(C)c4)CCO[C@@H]3C2)no1 | 0.602222 |
CC[C@@H](C)n1c(S[C@@H]2CCCCNC2=O)nc2sc3c(c2c1=O)CCCCC3 | COc1ccc(C(=O)Nc2ccc(Cc3noc(C(C)C)n3)cc2)cc1S(=O)(=O)N1CCCCC1 | 0.706759 |
COC(=O)CCNC(=O)N1CCc2nc[nH]c2[C@@H]1c1cccc(OC)c1OC | C[C@@H]1Cc2c(nn(C)c2C(=O)NCCc2ccnc(O)c2)[C@H](C)O1 | 0.741379 |
CCc1onc(C)c1NC(=O)NCCc1cccc2c1OCCO2 | Cc1c(OCc2c(F)cccc2Cl)c(=O)ccn1Cc1ccccc1 | 0.504464 |
CC(=O)Nc1nc2c(s1)CN(S(C)(=O)=O)CC2 | CC1(C)CC(NC(=O)Cn2nc(-c3ccc(Cl)cc3)c3ccccc3c2=O)CC(C)(C)N1 | 0.566176 |
CS(=O)(=O)N(CC(=O)Nc1ccccc1C(N)=O)c1cccc(F)c1 | C[C@@H]1CCN(C(=O)CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)c2ccccc2S1 | 0.51566 |
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