p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
Cc1ccc(-c2cc3n(n2)[C@@H](NCc2ccc(F)cc2)CNC3=O)cc1 | COC(=O)[C@H]1C(=O)C2=C(C[C@H]1C)NC(=O)C[C@H]2c1ccc(Cl)cc1 | 0.687943 |
O=C(NC[C@H]1O[C@H](Cc2cc(CN3CCNCC3)on2)CC[C@@H]1O)c1ccc2c(c1)OCO2 | O=C(CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1)Nc1c(Cl)cccc1Cl | 0.571732 |
C=CCSc1nnc2c(n1)O[C@H](/C=C/c1ccccc1)Nc1ccccc1-2 | COCCNc1nc(Cn2nc(OC)c3ccccc3c2=O)cc(=O)[nH]1 | 0.652621 |
COc1cc2nc(-c3ccccc3SC)oc(=O)c2cc1OC | Cc1cc(C(=O)NC2([C@@H]3CCCN(C(=O)c4cc5cc(O)ccc5[nH]4)C3)CC2)cc(O)n1 | 0.612802 |
Oc1ccc([C@@H](c2nnnn2CCc2ccccc2)N2CCN(c3nc4ccccc4s3)CC2)cc1 | Cc1ccc(C(=O)[C@@H]2Oc3ccccc3[C@@H]3CC(c4ccccc4)=NN23)cc1 | 0.731658 |
COc1ccc(CCNC(=O)CSc2nnc3ccc(-c4cccc(OC)c4)nn23)cc1 | CN=c1[nH]c([C@@H]2CCCN2C(=O)c2cnccn2)c2sccn12 | 0.63627 |
Cc1ccc(C(N)=O)c(-c2cccc(OC(F)(F)F)c2)n1 | Cc1occc1-c1nnc(SC[C@H](O)COc2cc(Cl)ccc2Cl)n1C | 0.524972 |
O=C(NC1CCCCCC1)[C@H]1Cc2ccccc2CN1C(=O)OCc1ccccc1 | O=C1CN(c2ccc(Nc3ncnc4c3CCCC4)cn2)CCN1 | 0.578158 |
C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc(-c3ccc(N)cc3Br)o2)C1 | COc1cccc(-n2nc(C)c([C@@H]3COCCN3CCOCC(F)F)c2C)c1 | 0.525242 |
COc1ccc(-c2ccc3n(c2=O)C[C@H]2C[C@@H]3CN(C(=O)c3ccncc3)C2)cc1 | Cc1cc2nc([C@@H]3CCCN(Cc4cccc5cccnc45)C3)cc(C(F)(F)F)n2n1 | 0.75739 |
COc1ccccc1CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 | COc1ccc(F)cc1S(=O)(=O)N[C@H]1C[C@H]2CC[C@@H]1C2 | 0.562044 |
COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1cccc(OC)c1Cl | COc1ccc(-c2c(C)c3ccc(O)c(CN4CCN(CCO)CC4)c3oc2=O)cc1OC | 0.651996 |
CCc1ccc(-n2nnc(-c3nsc(NC(=O)c4ccc(Cl)cc4)n3)c2C)cc1 | CCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Cl)c(O)c(OC)c1 | 0.677584 |
CN(C)c1c(Cl)cccc1NC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 | O=C(Nc1ccc(Oc2ccncc2)c(Cl)c1)[C@H]1C[C@H]2CC[C@H]1O2 | 0.554762 |
O=C1N=C(N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)S/C1=C\c1cccc([N+](=O)[O-])c1 | CCOc1cc(/C=C2/NC(=O)NC2=O)cc(Br)c1OCc1ccc2ccccc2c1 | 0.536957 |
O=C(Nc1cccc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C2)c1)c1cccs1 | CC(C)C(=O)Nc1nnc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccco2)s1 | 0.554713 |
Cc1ccc(Cn2nnc3c(=O)[nH]c([C@@H]4CCCN(C(=O)c5ccccc5C)C4)nc32)cc1 | CCn1nc(C)c(CNC(=O)c2cn(Cc3ccccc3C)nn2)c1C | 0.619442 |
COc1cccc(C(=O)COC(=O)[C@H](CC(=O)c2ccccc2)Nc2ccc(C)cc2C)c1 | Cc1ccccc1[C@@H]1CC(=O)c2cnc(NC[C@H]3CCCO3)nc2C1 | 0.542354 |
Cc1c(-c2cnn(C)c2)nc(N)c(C#N)c1-c1cnc(N2CCCC2)s1 | Cc1ccc(F)c(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2cncn2C)c1 | 0.704154 |
CC(C)n1nc(-c2ccccc2)nc1[C@H]1CC[C@@H](O)[C@H](NC(=O)COc2ccccc2)C1 | COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CC(=O)Nc3cc(F)ccc3F)C2=O)cc1 | 0.655031 |
O=C(c1nnn(Cc2ccccc2F)c1-c1ccncc1)N1CCc2ccccc21 | Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C(=O)O)cc1Cl | 0.626042 |
CCN(CC)CCn1cc(NC(=O)c2ccccc2[N+](=O)[O-])cn1 | CC(C)c1ccc([C@H]2/C(=C(\O)c3ccccc3)C(=O)C(=O)N2C[C@@H]2CCCO2)cc1 | 0.538703 |
CCOc1ccc(Br)cc1/C=C1/C(=O)N(C)C(=S)N1C | O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\Nc1ccc(F)cc1 | 0.512304 |
Cc1cccc(C2(C(=O)N3CCN(c4cnn(C)c4)C(=O)C3)CCCC2)c1 | CCN(CC)C(=O)Cn1cc(/C=C2/C(=O)N(c3cccc(C)c3C)C(=O)N=C2O)c2ccccc21 | 0.672065 |
C=CCSC1=Nc2c(cnn2-c2ccc(C)cc2)C2=NCCCN12 | Cc1nn(C)cc1CNC(=O)c1cc(Br)c(Br)s1 | 0.529959 |
CC(=O)N1CCc2ccc(S(=O)(=O)N[C@@H]3CN(C)C[C@@H]3C)cc21 | C#CCN(Cc1nc([C@@H](C)OCC)no1)[C@@H]1CCc2ccccc21 | 0.533116 |
Cc1nc([C@H](C)NC(=O)c2cccc(-c3ncc[nH]3)c2)n[nH]1 | O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N(Cc1ccncc1)C[C@H]1CCCO1 | 0.501046 |
CC(C)(Oc1ccc(Cl)cc1)C(=O)N1CCO[C@H](c2cccnc2)C1 | Cc1ccc2[nH]c(C(=O)N3CCC=C(c4cnn(C)c4)C3)cc2c1C | 0.528239 |
Cn1ccnc1[C@H]1N(C(=O)N[C@H]2CCOc3c(F)cccc32)CC1(C)C | CN(C)CCn1nc(-c2cnn(CCO)c2)nc1[C@@H]1C[C@H]1c1ccnn1C | 0.698658 |
Cc1cccc2[nH]c(CNc3nnc(-c4ccccn4)s3)nc12 | CCc1cccc2c1N[C@H](c1ccccc1C(=O)O)[C@H]1CC=C[C@H]21 | 0.581096 |
COc1ccc(N2C(=O)[C@@H]3[C@@H](N=NN3CC(=O)Nc3ccc(C)cc3Cl)C2=O)cc1 | O=C(NCc1ccc(Cl)cc1)C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12 | 0.644654 |
C[C@@H](N)Cn1cc(C(=O)Nc2cccc(-c3ncco3)c2)cn1 | Cc1[nH]c2ccc(C(=O)N3CCN(S(=O)(=O)c4cc(F)ccc4F)CC3)cc2c1C | 0.522503 |
COc1cc(OC)cc(C(=O)NCCn2ccn3nc(-c4cc(C)ccc4C)cc3c2=O)c1 | COc1ccc(NC(=O)CN(Cc2ccccc2)S(=O)(=O)c2ccccc2)cn1 | 0.592397 |
CCOc1ccccc1N1C[C@H](C(=O)Oc2ccc(N3C(=O)[C@H]4CC=C(C)C[C@H]4C3=O)cc2)CC1=O | CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1c[nH]nc1[C@@H]1CCNC1 | 0.543264 |
CCOC(=O)c1c(C)oc2ncn(CC(=O)N[C@@H]3CCCC[C@@H]3C)c(=O)c12 | COc1cccc(CC[C@H]2CCCN(C(=O)c3cnc(C)cn3)C2)c1 | 0.515658 |
COc1ccc(C2=NN(C(=O)CONC(C)=O)[C@@H](c3ccco3)C2)cc1 | COc1cc(/C=C/C(=O)OCC(=O)Nc2ccccc2C(C)C)cc(OC)c1OC | 0.5 |
O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCC(C(=O)O)(c2ccccc2)CC1 | O=C(NCCc1cnc[nH]1)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12 | 0.598377 |
COc1ccc(-c2nc(Cc3noc([C@@H]4C[C@@H]4[N+](=O)[O-])n3)co2)cc1 | Cc1ccc(-n2c(S[C@@H](C)C(=O)NC(N)=O)nnc2-c2ccccc2)cc1 | 0.585576 |
CC(C)Oc1ccc(C(=O)N2C[C@@H](O)[C@H](NS(C)(=O)=O)C2)cc1 | Cc1cccc(NC(=O)Cc2nc3sc4c(c3c(=O)[nH]2)CCCS4)c1C | 0.54536 |
NC[C@@H]1CCC[C@H]1NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2 | COc1ccc(NC(=O)c2ccc(N3C(=O)[C@@H]4[C@@H]5C=C[C@H]([C@H]6C[C@H]56)[C@@H]4C3=O)cc2)cc1 | 0.535342 |
O=C(NCc1cccc2ncsc12)[C@@H]1CC(=O)N(Cc2cccnc2)C1 | COC(=O)c1c(OCc2ccc(F)cc2)cc(=O)n2c1CCN(Cc1cccnc1)CC2 | 0.614746 |
Cc1cc(F)ccc1NC(=O)Cn1cc(C=O)c2ccccc21 | CN(C)CCCN(Cc1cc2cc3c(cc2[nH]c1=O)OCCO3)C(=O)Nc1ccc(F)cc1 | 0.558628 |
O=C(c1c[nH]nc1-n1cnnn1)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 | C[C@@H](NC(=O)c1nn[nH]c1-c1ccccc1)c1nnnn1C1CC1 | 0.597677 |
CC1=C(C(=O)OCc2ccc(C)cc2)[C@H](c2cccc(Cl)c2Cl)CC(=O)N1 | O=C(NC1CCCCCC1)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 | 0.549145 |
O=C(NCc1cc(-c2ccoc2)cs1)c1ccc2ncsc2c1 | Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc3ccccc3[nH]2)cc1C | 0.556522 |
CCNC(=O)[C@H](CC)N(Cc1ccc(C)cc1)C(=O)CSCc1c(F)cccc1Cl | Cc1c(C(=O)OCCCC#N)sc2nc3n(c(=O)c12)CCC3 | 0.588776 |
CC(=O)c1[nH]c(C)c(C(=O)N2C[C@H]3CC[C@]4(NC(=O)c5ccccc5N4)[C@H]3C2)c1C | CC(=O)N1CCN(C[C@@]2(O)CCCN(C(=O)c3cc(C(F)(F)F)n[nH]3)CC2)CC1 | 0.574247 |
CN(C)S(=O)(=O)c1ccc(OCC(=O)N(Cc2ccccc2)Cc2ccccc2)c(Cl)c1 | CN(C)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 | 0.521569 |
CC[C@H](C(=O)N1CCN(Cc2ncccc2C)CC1)n1cccn1 | CCOc1ccc(C(=O)C2=C(O)C(=O)N(CCCN(CC)CC)[C@H]2c2ccccn2)cc1 | 0.601042 |
O=C1[C@H]2CC[C@H](CN(Cc3ccc4ccccc4n3)C2)N1Cc1cscn1 | O=C(Cc1ccccn1)N1CCC[C@@H](n2nc(-c3cccs3)ccc2=O)C1 | 0.579281 |
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cnc2sc(C)c(C)n2c1=O | C[C@@H](NC(=O)[C@@H](CCS(C)(=O)=O)N1C(=O)c2ccccc2C1=O)c1ccc2c(c1)OCCO2 | 0.682186 |
COc1cccc(C[C@@H](C2CCN(C(=O)c3cccc(C)n3)CC2)N(C)C(=O)c2ccn(C)n2)c1 | O=C(CCn1cnc2ccccc2c1=O)NCc1nc(C2CCOCC2)no1 | 0.556745 |
NC(=O)c1nc(-c2ccnc3ccccc23)nc2c1[nH]c(=O)n2CCc1ccccc1 | NC(=O)C1(NC(=O)c2occ3c2CCC3)CCOCC1 | 0.661538 |
N#C[C@@]1(C(=O)c2ccc(Cl)cc2)Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@@H]21 | C[C@@H]1CCc2c(sc(NC(=O)c3nc[nH]n3)c2C#N)C1 | 0.65902 |
CC[C@@H](Sc1nc(=O)cc(N)n1CCc1ccccc1)C(=O)Nc1cc(C)on1 | O=C1/C(=C\c2c(N3CCCCC3)nc3ccccn3c2=O)SC(=S)N1C[C@@H]1CCCO1 | 0.691919 |
Cc1ccsc1CN(C(=O)c1ccnn1C)C1CCCC1 | CCn1nc(C)c2c(C(=O)NCC(C)C)cc(C)nc21 | 0.571273 |
Cc1cc(C(=O)N2CCC3(CC2)OCCN3S(=O)(=O)c2cccs2)c(C)o1 | O=C(CSc1nc(O)c2cc(I)ccc2n1)N1CCCCC1 | 0.510995 |
CC(C)[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NC[C@@H](C)c1ccccc1 | Cc1ccc2sc(N3CCN(C(=O)c4cc(=O)c5ccccc5o4)CC3)nc2c1C | 0.639918 |
O=c1c2c3c(sc2ncn1Cc1ccccc1)C[C@H](NCc1cccc(-n2cccn2)c1)CC3 | O=C(COC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1)Nc1nccs1 | 0.639959 |
Cc1ccc(CN2CC[C@@]3(CC(C(=O)NC[C@H](C)c4ccccc4)=NO3)C2)cc1 | Cc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1C(=O)NCc1ccc(OC(C)C)cc1 | 0.512644 |
CCC(CC)n1ncc(C)c1NC(=O)c1cccnc1OC | CC1(C)C[C@H](NC(=O)COc2ccc(C(C)(C)C)cc2)c2ccccc2O1 | 0.532741 |
Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1Cc1cccc2cccnc12 | CC(C)c1cc(C(=O)N2C[C@H](O)C[C@H]2c2cccc(F)c2)n[nH]1 | 0.706967 |
Cc1ccc([C@@H]2CC(=O)c3cnc(NC(=O)c4ccc(Cl)cc4)nc3C2)cc1 | Cc1ncc2n1-c1ccc(Cl)cc1C(c1ccccc1F)=NC2 | 0.621901 |
Cc1ccc(OC2CCN(C(=O)c3c[nH]nc3-c3ccccc3Cl)CC2)nc1 | CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)cc1 | 0.513889 |
O=C(Nc1nnc(-c2ccccn2)s1)N[C@@H]1CCN2CCCC[C@@H]12 | CC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(-c3ccccc3Br)[nH]2)c1C | 0.550955 |
CCN1C(=O)/C(=C\c2c(N3C[C@@H](C)O[C@H](C)C3)nc3c(C)cccn3c2=O)SC1=S | O=C(CSc1ccc2c(c1)OCCCO2)c1ccc(S(=O)(=O)N2CCOCC2)cc1 | 0.567901 |
CCOCCOc1ccc(CN(C)C[C@]2(O)CCN(c3ccccn3)C2)cc1 | CCOc1ccc([C@@H]2Nn3c(nnc3-c3ccccc3)S[C@H]2C(=O)Nc2ccccc2F)cc1 | 0.596691 |
CC[C@H]1CCN1C(=O)c1cnn(-c2ccc(F)cc2F)c1C | COCCn1cc(CN2CCN(c3ccc(F)cc3C(N)=O)CC2)cn1 | 0.502252 |
O=C1C[C@H](c2nc(-c3cccc(Cl)c3)no2)CN1CCc1ccccc1 | CCOC(=O)c1sc(C2CCN(S(=O)(=O)NC)CC2)nc1C | 0.514607 |
CC(C)OC(=O)c1c(NC(=O)COc2ccccc2)sc2c1CC[C@@H](C)C2 | CCN1C[C@@H](CNS(=O)(=O)c2cc(C(N)=O)cs2)CC1=O | 0.561762 |
Cc1cccnc1C1(O)[C@H]2CCC[C@H]1CN(Cc1cnc(N(C)C)nc1)C2 | CCc1ccc(S(=O)(=O)N2CCC(CSCc3ccco3)CC2)s1 | 0.524807 |
O=c1nc2n(c3ccccc13)CC/C2=C\c1ccc(OCc2ccccc2)cc1 | CN(Cc1nc(-c2cccnc2)no1)S(=O)(=O)c1ccc2ccccc2c1 | 0.548387 |
Cc1[nH]c2ccccc2c1C(=O)C(=O)NCc1nnnn1-c1cccc(F)c1 | CC(C)[C@@H](Cn1nc(-c2cccs2)ccc1=O)NC(=O)Cn1cnc2ccccc21 | 0.65109 |
CCc1ccc(-c2noc(CCN3C(=O)[C@@H](C)Oc4ccccc43)n2)cc1 | O=C(CCn1c(CO)nc2ccccc21)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1C2 | 0.525696 |
COC(=O)c1[nH]c2ccccc2c1NC(=O)c1ccccc1F | O=C(N[C@@H]1CCCCC12CCCC2)c1ccc2oc(O)nc2c1 | 0.527655 |
CC(=O)N1c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2C[C@@H]1C | COCC(=O)Nc1cc(C(=O)N[C@H](C(=O)OC)c2ccccc2)cc2nc(-c3ccccc3)n(C)c12 | 0.652621 |
CCc1nc(N)c(C#N)c(-c2ccc(Cl)cc2Cl)c1C | COc1ccc(-c2nc(NC(=O)CCc3nc(-c4cccs4)no3)sc2C)cc1 | 0.569742 |
C[C@H](NC(=O)c1sccc1C1CC1)c1ccc(-n2cncn2)cc1 | Cc1cc(N2C[C@@H](C)O[C@H](c3ccsc3)C2)nc(-c2cccnc2)n1 | 0.584946 |
Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CO[C@@H]3Cc3nnc(C4CC4)o3)C2)on1 | O=S1(=O)C[C@@H]2SC(=S)N(Cc3ccccc3)[C@H]2C1 | 0.528261 |
Cc1nc(NC(=O)N[C@H]2CCO[C@H](c3ccnn3C)C2)ccc1-c1ccccc1 | CCOc1ccc2c(c1)sc(=NC(=O)c1ccn(C)n1)n2C | 0.626431 |
CCc1ccccc1N1C(=O)N(c2ccc(F)cc2)[C@H]2CS(=O)(=O)C[C@@H]21 | CC1CCN(c2nc3c(c(=O)[nH]2)CCN(Cc2ccccc2F)C3)CC1 | 0.596215 |
Cc1ccccc1OCC(=O)N1CCC[C@@H](c2ncc(Cc3ccccc3)o2)C1 | Cc1noc(C)c1CN1C[C@H]2[C@H](NC(=O)CC3=CCCC3)CS(=O)(=O)[C@H]2C1 | 0.577167 |
COc1ccc(-c2cc(C(=O)Nc3ccc(Cl)c(Cl)c3)no2)cc1OC | COc1cc(F)ccc1[C@H](C(=O)O)N1CCN(c2ncccn2)CC1 | 0.518771 |
C[C@@H](C1CC1)N(C(=O)c1n[nH]c2ccccc2c1=O)C1CC1 | COc1ccc(C(=O)NC2CCN(c3ncccc3C#N)CC2)c(OC)n1 | 0.562084 |
O=C(c1ccnc(-c2cncnc2)c1)N1CCC[C@H](c2cccc(Cc3ccc(F)cc3)n2)C1 | Cc1cc(CNc2nnc(-c3ccc4c(c3)CCC4)o2)ccc1-n1cncn1 | 0.579171 |
Cc1nn(C)c(C)c1CCC(=O)N1CC[C@@]2(CCCN(CCc3ccccc3)C2)C1 | O=C(N1CCOC[C@H](Cc2ccc3ccncc3c2)C1)C1(Cc2ccccc2)CCOCC1 | 0.50828 |
CC(C)(C)[C@@H]1CCc2c(sc3[nH]c(=O)[nH]c(=O)c23)C1 | CCn1c(SCC(N)=O)nc2cc(C)[nH]c2c1=O | 0.58811 |
O=C(c1n[nH]c2ccccc12)N1CCN(c2cnccn2)CC1 | O=C(NCc1ccccc1CN1CCOCC1)/C(=C/c1cccs1)NC(=O)c1ccccc1 | 0.501779 |
COc1cc(/C=C2/NC(=O)N(c3ccc(Cl)cc3)C2=O)ccc1OCC(=O)Nc1ccccc1 | Cc1ccccc1Oc1ncccc1CNC(=O)Cn1ccnc1C | 0.522422 |
COc1ccccc1N1CCN(c2cc(C)nc(-n3nc(C)cc3C)n2)CC1 | Cc1ccc(C)c2c1NC(=O)[C@H]2CC(=O)N(C)Cc1[nH]nc2c1CCC2 | 0.643821 |
Cc1cc(C[C@@H]2CN(Cc3nc(N)c4c5c(sc4n3)CCCC5)C[C@@H]2O)on1 | CCC(C#N)(CC)C(=O)N1CC[C@H](c2ccco2)C1 | 0.505796 |
O=C(CN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cccn1C1CCCCC1)Nc1ccccc1 | O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1cccc2ncccc12 | 0.575693 |
CN(c1cccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3Cl)C2)c1)S(C)(=O)=O | COC(=O)CC1=NN(c2ccc(OC(F)(F)F)cc2)C(=O)/C1=C(/C)NCc1ccccc1 | 0.550478 |
CN1C(=O)CO[C@H](C(=O)N2CC[C@H](C3CC3)C2)[C@H]1c1cccnc1 | CN(Cc1nc(Cc2ccccc2)no1)C[C@@]1(c2ccccc2)CC1(C)C | 0.558036 |
CN(CCn1cccn1)C(=O)[C@@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 | Cc1c(C)n(Cc2ccncc2)c2ncn3nc([C@@H](C(C)C)N4C(=O)c5ccccc5C4=O)nc3c12 | 0.520284 |
CC(=O)[C@@H](C(=O)Nc1ccccc1)C1c2ccccc2Oc2ccccc21 | COc1ccc2c(c1)c1ncnc(N3C[C@@H](C)O[C@@H](C)C3)c1n2C | 0.56391 |
O=C(c1ccc(-c2cccc(F)c2)nc1)N1CCC[C@@H]1c1ccccn1 | CCCCNC(=O)[C@@H](C)N(Cc1ccc(F)cc1)C(=O)CN(c1ccccc1C)S(C)(=O)=O | 0.602371 |
C[C@H]1Cc2cc(C(=O)NCc3ccco3)ccc2N1S(=O)(=O)c1ccc(Cl)cc1 | Cc1nccn1-c1cncc(N2CC[C@H](C3CC3)[C@H]2c2nnc(O)n2C)n1 | 0.725471 |
Cc1cnc(CNC(=O)c2nc(-c3cn(C(C)C)c(C)n3)n3ccccc23)cn1 | CC1(C)CN(c2nnc(-c3ccccc3)s2)CC[S@]1=O | 0.525478 |
COCCNc1cc(C)c2cccc(OC)c2n1 | CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)CN2C(=O)N[C@@](C)(c3ccc(Cl)cc3)C2=O)c1 | 0.517685 |
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