p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
O=C(c1cccc2c1OCCO2)N1CCCC[C@H]1CO
|
CNC(=O)c1cc(O[C@@H]2CCCN(C(=O)c3ccc(C(F)(F)F)nc3Cl)C2)ccn1
| 0.624122 |
Cc1cc(C(=O)N2CCC[C@@H](COc3ncccc3C(F)(F)F)C2)n(C)n1
|
CNC(=O)[C@H]1CN(C(=O)c2cncs2)CCN(S(C)(=O)=O)C1
| 0.523973 |
COCCOc1ncccc1C(=O)N1CCN(C(=O)N2CCCCC2)CC1
|
CCOC(=O)[C@@]1(C[C@H]2CC(c3ccc(F)cc3)=NO2)CCCN(S(=O)(=O)CC)C1
| 0.501085 |
COc1ccc(CCNC(=O)CCC(=O)N2CCc3[nH]c4ccc(F)cc4c3C2)cc1OC
|
Cc1ccc(/N=C2/NC(=O)/C(=C/c3cccc(Br)c3)S2)c(C)c1
| 0.536935 |
CC(=O)N(C)Cc1nc(-c2cccc(OCc3cccnc3)c2)no1
|
Cc1cc(OC(=O)[C@@H]2CC(=O)N([C@H](C)c3ccccc3)C2)ccc1N1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O
| 0.526144 |
CN(C)S(=O)(=O)c1cccc(COc2ccc3c(-c4ccccc4)cc(=O)oc3c2)c1
|
COC[C@@H](C)NC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(OC)c(OC)c1
| 0.575083 |
COc1ccc(CN2CCN(c3ncc(F)cn3)C[C@@H]2C)cn1
|
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)NCc3ccc(-c4cnc[nH]4)cc3)c12
| 0.526203 |
O=C(/C=C/c1ccsc1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2
|
COc1ccc([C@@H](CNc2oc(-c3ccco3)nc2C#N)N2CCCCC2)cc1
| 0.60176 |
Cc1nc(C(=O)O[C@@H]2CCCC(=O)N(C)C2)nn1-c1ccccc1C(C)C
|
CC(=O)N1C[C@@H]2C[C@]2(C(=O)Nc2ccc(OC3CCCC3)nc2)C1
| 0.577754 |
C[C@@H](NC(=O)N1CCO[C@]2(CCS(=O)(=O)C2)C1)c1nc2ccccc2[nH]1
|
Cc1cc(C)nc(N/N=C2/C[C@@H](c3ccccc3)Oc3ccccc32)n1
| 0.524168 |
COc1ccc(Cl)cc1NC(=O)c1cccnc1NCCc1ccccc1
|
COc1ccccc1CN1C[C@H](C(=O)N2CCCCO2)[C@H]2OCC[C@H]21
| 0.549626 |
COCCN1Cc2nnc(CCc3ccccc3O)n2[C@@H](C)C1=O
|
O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N(C[C@@H]1CCOC1)c1ccccc1
| 0.589474 |
COc1cc(C)c([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1C(C)C
|
COc1ccc(/C=C/C(=O)OCC(=O)N2CCc3ccccc32)cc1OC
| 0.519002 |
CC(C)c1ccc(S(=O)(=O)Nc2ccc(O)c(Sc3ncn[nH]3)c2)cc1
|
Cc1nccn1CCCNC(=O)c1cnn(-c2ccc(O)nn2)c1C(F)(F)F
| 0.502141 |
CCn1c([C@@H](C)NC(=O)c2ccc(S(=O)(=O)N3CCCC[C@H]3C)cc2)nc2ccccc21
|
CC[C@H](Oc1ccc(C)c(C)c1)C(=O)Nc1ccccc1C(=O)NCCCOC
| 0.548955 |
COC(=O)CN1C(=O)N/C(=C/c2cc(C)n(-c3cccc(Cl)c3Cl)c2C)C1=O
|
COn1c(SCc2cccc(Cl)c2)nc2ccccc2c1=O
| 0.549102 |
CCOc1ccc(N(CC(=O)NCc2ccc(OC)cc2)S(=O)(=O)c2ccc(F)cc2)cc1
|
O=C(CN1CCOCC1=O)N[C@H]1CC2(CCCC2)Oc2ccccc21
| 0.573021 |
CCn1cc(CN2CCC[C@H](c3nnc(CN4CCOCC4)n3C)C2)cn1
|
Cc1ccc2nsnc2c1S(=O)(=O)N1CCC2(CCNC(=O)CC2)CC1
| 0.566098 |
CC(=O)Nn1cc2c(c1-c1ccccc1)c(=O)n(C)c(=O)n2C
|
Cc1cc(NC(=O)CN[C@@H](c2ccccc2)C(C)C)n(-c2ccccc2)n1
| 0.584615 |
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCCc1ccccc1
|
CCC[C@H]1CCc2sc(C(=O)N(Cc3cocn3)Cc3cocn3)cc2C1
| 0.511526 |
Cc1cc(-c2ccc(-n3ccnc3)nn2)ccc1O
|
COc1ccccc1/C=C1/Oc2c(ccc3c2[C@@H](c2coc4ccccc4c2=O)CC(=O)O3)C1=O
| 0.54002 |
COC(=O)c1ccc(CN2C(=O)N[C@@](C)(c3ccccc3Cl)C2=O)cc1
|
COc1ccccc1[C@H]1CN(C(=O)c2cc[nH]c2C)CCN1
| 0.593258 |
Cn1ncc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)c1C(F)F
|
Cc1noc(C)c1[C@H](C)CC(=O)N1CCOC[C@H]1c1cccn1C
| 0.57265 |
COc1ccc([C@@H]2CC(=O)c3c([nH]c(C(=O)OCc4ccccc4)c3C)C2)cc1
|
Cc1[nH]nc(O)c1C(c1cc([N+](=O)[O-])ccc1Cl)c1c(O)n[nH]c1C
| 0.545648 |
CNC(=O)Cc1cccc(OC(=O)c2c[nH]nc2-c2ccsc2)c1
|
Cc1ccc([C@@H](C)NC(=O)CN(c2ccccc2F)S(=O)(=O)c2cccs2)cc1
| 0.530481 |
CC(=O)N[C@@H](CC(=N)O)[C@H](O)[C@H](O)C(=O)N[C@@H](CC(C)C)[C@@H]1Cc2cccc(O)c2C(=O)O1
|
CN(C1CCCCC1)[C@@H]1OC(=O)c2ccccc21
| 0.540511 |
O=c1oc2c(CN3CCCC4=C[C@H]5C[C@H](CN6CCCC[C@H]56)[C@@H]43)c(O)ccc2c2c1CCCC2
|
C[C@H](NC(=O)C1CCN(c2cc(Oc3ccccc3)ncn2)CC1)c1ccc(F)cc1
| 0.609148 |
Cc1ccc(NS(=O)(=O)c2cc(C(=O)NCc3ccc(-n4ccnc4)cc3)ccc2Cl)cc1C
|
Cn1c(CN2CCC[C@@H](c3nc4c(s3)CCCC4)C2)cc(=O)n(C)c1=O
| 0.585921 |
C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Nc1cc(C(F)(F)F)ccc1F
|
O=C1N/C(=N/c2cccc(C(F)(F)F)c2)S/C1=C1\C(=O)Nc2ccccc21
| 0.538789 |
O=C(CN1C(=O)C(=O)N(Cc2cccs2)C1=O)Nc1ccccc1C(F)(F)F
|
COc1ccc(N(CC(=O)Nc2cccc(F)c2)S(C)(=O)=O)c(OC)c1
| 0.513935 |
C=CCOc1ccc([C@@H]2SCC(=O)Nc3c2c(O)nn3[C@H](C)CC)cc1
|
COc1cccc(OC)c1C(=O)Nc1nnc(SCc2ccc(F)cc2)s1
| 0.561181 |
CCCc1cc2c(=O)c(-c3nc(C)cs3)coc2cc1O[C@@H](C)C(=O)OCC
|
CCOC(=O)NC(=O)CSc1nc2cc(S(=O)(=O)N(C)C)ccc2o1
| 0.558333 |
CCOc1ccc(NC(=O)CSc2nnc(-c3cccnc3)n2-c2ccc(OCC)cc2)cc1
|
Cc1ncc(-c2ccc(NC(=O)CCNS(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2)o1
| 0.536854 |
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2CCCN(c3cc(-c4ccc(F)cc4)n[nH]3)C2)CC1
|
COc1ccc2nc(SCC(=O)Nc3ccccc3C(=O)Nc3ccccc3)[nH]c2c1
| 0.53118 |
Cn1nc(C(=O)N2CC(n3cc(COc4ccccc4)nn3)C2)ccc1=O
|
CN(CCO)c1ccc(C(=O)N2CC[C@@H]3OCc4cnnn4[C@@H]3C2)cc1
| 0.651337 |
COc1ccc(S(=O)(=O)N(C)CCCC(=O)NCC(C)(C)CO)cc1
|
COc1ccc(S(=O)(=O)N(CC(=O)NC2CCCC2)C2CCCCC2)cc1Cl
| 0.577904 |
O=C1c2ccccc2CCC[C@@H]1c1sc([N+](=O)[O-])cc1[N+](=O)[O-]
|
CCc1n[nH]cc1C(=O)N[C@H]1C[C@H](c2cc(=O)[nH]c(C3CC3)n2)C1
| 0.582105 |
O=C(CN1CCc2ccccc2C1)Nc1c[nH]c2ccccc12
|
C[C@H](C(=O)Nc1ccccc1C(=O)N1CCCC1)N(c1ccc(F)c(F)c1)S(C)(=O)=O
| 0.538031 |
Cc1ccc(-c2nc(CNC(=O)Cn3nnnc3N)[nH]c2-c2ccccn2)cc1
|
CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(S(N)(=O)=O)cn1
| 0.605096 |
CC(=O)c1cc(CC(=O)N[C@H]2COC[C@H]2Cc2cc(C)no2)cs1
|
CCCNC(=O)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1
| 0.588785 |
O=C1COc2ccc(F)cc2N1Cc1ccccn1
|
O=C(c1cnoc1-c1ccccc1)N1CCN[C@@H](c2ccccc2)C1
| 0.530067 |
Cc1ccc(-n2c(-c3ccccc3)cnc2SCC(=O)Nc2nnc(C)s2)cc1
|
Cc1ccc(-c2cnc(CCC(=O)Nc3nccs3)o2)cc1
| 0.537853 |
COC(=O)c1c(NC(=O)Cc2ccccc2)sc2c1CC[C@@H](C)C2
|
COC(=O)c1ccccc1NC(=O)CSc1nnc(COc2ccc(Cl)cc2C)o1
| 0.612903 |
CCc1ccc([C@H]2CNCCN2C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)cc1
|
NC(=O)N[C@H](CC(=O)N1CCC[C@H]1c1nc2ccccc2s1)c1ccccc1
| 0.522222 |
Cc1c(/C=N\c2cccc(Cl)c2)c2ccccc2n1C
|
C[C@]1(c2nc(-c3ccccc3)nn2-c2ccc(S(C)(=O)=O)cc2)CCCO1
| 0.529289 |
O=C1[C@H]2CC=CC[C@H]2C(=O)N1Cc1nnc(-c2ccccc2)o1
|
Cc1nc2ncccc2c(=O)n1-c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1
| 0.554025 |
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1Cc1ncccn1
|
CCCn1nccc1C(=O)N1CCN(c2ccccc2F)CC1
| 0.525935 |
NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H]1CC(=O)N(c2ccc(F)c(F)c2)C1
|
Cc1cccc(NC(=O)/C=C/c2c(F)cccc2F)c1C(=O)N1CCCC1
| 0.529018 |
Cc1nc(O)c2c(n1)CN(c1ncnc3sc4c(c13)CCC4)C2
|
Cc1cn(C[C@H]2OC[C@@H](NC(=O)c3ccn(C(C)C)n3)[C@H](O)[C@@H]2O)c(=O)nc1O
| 0.752239 |
O=C1C(O)=C[C@@](O)(c2ccccc2)N1c1ccccc1
|
C[C@@H]1CN(C2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)C[C@H](C)O1
| 0.537528 |
O=C1c2ccccc2N[C@@H](c2ccc(O)cc2)N1Cc1ccc2c(c1)OCO2
|
COc1ccccc1[C@@H](CNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)N(C)C
| 0.598477 |
COc1cc(C(=O)Nn2c(CC(C)C)nc3ccccc3c2=O)cc(OC)c1OC
|
O=C(O)[C@H](Cc1sccc1Br)NC(=O)[C@@H]1CCCO1
| 0.502183 |
C#Cc1c(F)c(F)c(NC(=O)C2CCN(c3nc4ccccc4o3)CC2)c(F)c1F
|
N#Cc1cnn(CC(=O)NCCCCNc2cccc3c2C(=O)N([C@@H]2CCC(=O)NC2=O)C3=O)c1N
| 0.682801 |
C[C@@H]1CCCN(c2cc(C(=O)Nc3nncn3C)ccn2)C1
|
Cc1noc(C)c1CC(=O)Nc1cc(C(N)=O)ccc1N1CCCC1
| 0.514354 |
Cc1nonc1CN1CCN(c2cc([C@H]3C[C@@H](N)C3)nc(N)n2)CC1
|
Cc1cc(CN(C)S(=O)(=O)c2cncc(C(=O)O)c2)no1
| 0.503964 |
CCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)Oc1cc2oc(=O)cc(CC)c2cc1Cl
|
Cc1ccc2nc(COc3ccc(C(=O)N(C)C[C@H]4COc5ccccc5O4)cc3)cn2c1
| 0.595264 |
O[C@H]1[C@H](NCc2ccc(OC(F)(F)F)cc2)[C@H]2CO[C@H](O2)[C@@H]1N1CCCCC1
|
O=C(O)c1ncn2c1C(=O)N(Cc1ccccc1)CC2
| 0.570968 |
CCCCN1C(=O)N[C@@H](c2ccc(F)cc2F)C(C(=O)OC)=C1C
|
CCC(=O)N1CCN(c2nc(CC)nc3sc4c(c23)CCCC4)CC1
| 0.718967 |
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N1CCC(c2ccccc2)=N1
|
CN(C[C@@H]1CCc2nccn2C1)C(=O)c1cccc2[nH]ncc12
| 0.516667 |
CCCC(=O)c1cn(CC(=O)N2C[C@@H]3CCC[C@H](C2)C(=O)N3)c2ccccc12
|
CCCOc1ccc([C@@H]2C(C(=O)c3ccc(OC)c(OC)c3)=C(O)C(=O)N2CCN(CC)CC)cc1
| 0.683726 |
NC(=O)c1noc([C@H]2CCCN2S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)n1
|
C[C@@H](OC[C@H]1CCCCO1)C(=O)NS(=O)(=O)c1cccs1
| 0.509868 |
CNC[C@H]1CCN(C(=O)/C=C/c2ccc(OC)c(OC)c2)C1
|
C#CCOc1c(Br)cc(/C=C2\NC(=O)N(C3CCCCC3)C2=O)cc1OCC
| 0.511335 |
O=c1/c(=C\c2ccc(-c3ccccc3)o2)sc2nc(Cc3ccccc3)nn12
|
O=C(NCC(F)(F)F)c1ccc(NC(=O)C2(c3ccc(Br)cc3)CC2)cc1
| 0.5 |
COc1cc2c(cc1OC)CN1C(=S)N(c3ccc(C(F)(F)F)cc3)C(=O)[C@@H]1C2
|
CC[C@H]1CN(c2nc(C3CCCCC3)ns2)C[C@@H](C)S1(=O)=O
| 0.582816 |
Cc1ccc(C)c(N2CCN(C(=O)c3oc4ccccc4c3C)CC2)c1
|
c1ccc(COC[C@@H]2CN(Cc3cccs3)Cc3cncn3C2)nc1
| 0.537623 |
Cc1ccccc1CC(=O)N1CCC(n2c(-c3ccccn3)nc3ccccc32)CC1
|
OC[C@@]1(Cc2ccccc2F)CCCN(c2noc(-c3ccccc3)n2)C1
| 0.575789 |
Cn1cnnc1Sc1ccc(-c2cn(Cc3ccc(CO)cc3)nn2)o1
|
CCN(CC)c1ccc(/N=C(\C#N)C(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)cc1
| 0.540021 |
CS(=O)(=O)N1CCCc2cc([C@@H](O)CN3CCc4ccccc4C3)ccc21
|
Cn1cc(C(=O)N2C[C@@H]3C[C@@H](CC(=O)NCc4cccnc4)O[C@@H]3C2)c(C(F)F)n1
| 0.615873 |
Cc1noc(C[C@H]2C[C@H]3CN(Cc4sccc4C)C[C@H]3O2)n1
|
O=C(c1cc(-c2ccccc2)nc2ccc(Cl)cc12)N1CCOCC1
| 0.543646 |
COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)Nc1ccccn1
|
COCCN1C(=O)C[C@H](CNc2ncnc(N)c2Cl)[C@H]1c1cnn(C)c1
| 0.634791 |
COC(=O)C1=C(CN2CCC3(CC2)OCCO3)NC(=O)N[C@@H]1c1ccccc1Cl
|
O=C(O)c1cc2c(c(S(=O)(=O)N3CCN(CC4CC4)CC3)c1)CCC2
| 0.643154 |
COc1ccc(/N=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)cn1
|
CC[C@@]12COC(=O)N1CCN(C(=O)c1nc3ncccn3n1)C2
| 0.523707 |
CCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(Cc2ccco2)C1=O
|
CCN1CCN(C(=O)C[C@@H](O)C(C)C)C[C@@H]1c1nccn1C
| 0.526758 |
C[C@@H]1CCCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1
|
CCOc1ccc([C@@H]2c3c(-c4ccccc4O)n[nH]c3C(=O)N2C[C@@H]2CCCO2)cc1
| 0.713568 |
O=C(c1cc2c(s1)-c1ccccc1CC2)N(C[C@H]1CCCO1)c1ccncc1
|
CCOC(=O)N1CCc2c(sc(NC(=O)c3cc(OC)c(OC)c(OC)c3)c2C(=O)OC)C1
| 0.786787 |
O=C(c1ccccc1)c1c[nH]c2cc3c(cc2c1=O)OCCO3
|
CN1CC2(CCN(C(=O)C3(c4ccccc4)CCCC3)CC2)OC1=O
| 0.508989 |
Cc1ccc(NC(=O)C[S@@](=O)CC(=O)N[C@@H]2CCc3ccccc32)cc1Cl
|
COc1ccc([C@H](C)NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc4ccccc4c3)C2)cc1
| 0.523353 |
COc1ccccc1N1CCN(CC(=O)N2CCNC(=O)[C@H]2CC(=O)Nc2cccc(Cl)c2)CC1
|
CC(C)OC(=O)c1ccc2nc(NC(=O)Cc3ccc(Cl)cc3)sc2c1
| 0.507955 |
CCCNC(=O)[C@H](C)N(Cc1cccc(C)c1)C(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O
|
C[C@H]1Cc2cc(C(=O)Nc3cccc(Cl)c3)ccc2N1S(=O)(=O)c1ccc(F)cc1
| 0.670968 |
CCSc1cc([C@@H]2C(C(=O)OC)=C(C)NC3=C2C(=O)CCC3)c(C)o1
|
Cc1cc(C)n([C@@H](C)CC(=O)NCc2ccc(OCCCC(=O)O)cc2)n1
| 0.538144 |
Cc1ccc(Cl)cc1NC(=O)CNC(=O)c1ccc(COc2ccccc2C)o1
|
COc1ccc(NC(=O)NCCCCCc2n[nH]c(N)c2C#N)c([N+](=O)[O-])c1
| 0.516384 |
CC(C)N1CCC(c2nccnc2-c2nccn2C)CC1
|
Cc1nc2cc(NC(=O)[C@H](C)NS(=O)(=O)c3ccc4c(c3)OCCCO4)ccc2o1
| 0.504875 |
CC(C)[C@@H]1CN2C[C@@H](NC(=O)c3cnc(-c4cccnc4)nc3)C[C@H]2CO1
|
Cc1cc(NC(=O)[C@H](C)OC(=O)c2[nH]c3c(c2C)C(=O)CC(C)(C)C3)on1
| 0.595876 |
Cc1ccc([C@@]2(O)CCN(C(=O)COc3ccc(-n4nc(C)cc4C)nn3)C2)cc1
|
Cc1nnc(N2C[C@@H]3COC[C@]3(CNC(=O)c3cccnc3)C2)s1
| 0.570971 |
O=C(CN(Cc1ccc(Br)cc1)S(=O)(=O)c1ccccc1)Nc1cccc(F)c1
|
COc1cc(C(=O)NCc2cc3n(n2)CCCO3)cc(OC)c1OC(F)F
| 0.508399 |
COc1cccc([C@@H]2SCC(O)=Nc3c2c(C)nn3-c2ncccn2)c1OC
|
CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(O)nn1
| 0.509784 |
CCOC(=O)C1=C(C)OC(N)=C(C(=O)OC)[C@@]12C(=O)Nc1cc(Br)ccc12
|
COc1ccc(S(N)(=O)=O)cc1C(=O)OCc1cc(Cl)c2c(c1)OCO2
| 0.647059 |
COc1ccccc1NC(=O)[C@@H](C)N[C@H](c1ncccc1C)C(C)C
|
CCOc1ncccc1C(=O)N1C[C@H](OC)C[C@@H]1CC(=O)O
| 0.537778 |
CN(C)C[C@@H]1OCCN(C(=O)c2cc(C3CC3)[nH]n2)[C@H]1c1cnn(C)c1
|
O=c1[nH]c(=O)n(-c2ccccc2)c2c1CN(C1CCCCC1)CN2
| 0.687885 |
N#Cc1ccc2nc3c4ccc(C(=O)O)c5c(C(=O)O)ccc(c(=O)n3c2c1)c54
|
O=C(NCc1ccnc(-n2cccn2)c1)N1CC[C@@H]1c1ccccc1
| 0.51938 |
Cn1ccc(NC(=O)Cc2csc(-c3ccc4c(c3)OCO4)n2)n1
|
CN1CCN(Cc2nnc(C3CCN(c4ccc(F)cn4)CC3)n2C)CC1
| 0.526953 |
CC(C)(C)c1nc2cc(NC(=O)C3CCN(c4cnccn4)CC3)ccc2[nH]1
|
Cc1sc(/C=C/c2c3c(nn2C)CCCC3)nc1C(=O)O
| 0.515217 |
CC1(C)C[C@@H](n2nc(O)c3c2NC(=O)CS[C@@H]3c2cc(Cl)c3c(c2)OCO3)CCO1
|
Nc1nc(N[C@H](CO)CC2CCCCC2)cc(C2CC(N)C2)n1
| 0.532258 |
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCN(c4cccc(C)c4C)CC3)CC2)cc1C
|
Cc1cc(F)c(S(=O)(=O)N2CCOC[C@H]2C(=O)O)cc1F
| 0.557321 |
COc1ccc(-c2ccc(/C=C/C(=O)NO)o2)cc1[N+](=O)[O-]
|
CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N(c2ccccc2)[C@H]2CCS(=O)(=O)C2)C1=O
| 0.574844 |
CC[C@]1(O)CCCN(C(=O)c2ccccc2-c2ccncc2)C1
|
C=CCN1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N(CCCC)[C@H]2CCC)C1=O
| 0.56869 |
Cc1occc1C(=O)O[C@H]1CCCN(c2cc(C#N)ccn2)C1
|
CO[C@@H]1C[C@@H](c2ncc(-c3cccnc3)[nH]2)N(Cc2cn(C)nn2)C1
| 0.5397 |
O=C(Nc1cccc(OC(F)(F)F)c1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1
|
Cc1ccc(-c2nc(C#N)c(S(=O)(=O)NC[C@H](c3ccc(Cl)cc3)N3CCCCC3)o2)cc1
| 0.577046 |
COc1ccccc1NC(=O)CN(Cc1ccco1)C(=O)c1cc(C2CC2)nc2c1cnn2C(C)C
|
Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(Cc2ccccc2Cl)C1
| 0.632219 |
O=C(NCc1ccccc1)c1ccccc1OCc1nc(-c2ccccc2)no1
|
N#Cc1nc2c(s1)c(-c1ccccc1)nn2-c1ccccc1
| 0.530547 |
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