p1
stringlengths 12
119
| p2
stringlengths 12
119
| Scaffold
stringlengths 2
69
| similarity
float64 0.5
1
|
|---|---|---|---|
COC(=O)c1ccc(Nc2nccc(-c3ccc(OC)cc3)n2)cc1 | NS(=O)(=O)c1cccc(Nc2nccc(-c3ccccc3)n2)c1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.658147 |
COC(=O)c1ccc(Nc2nccc(-c3ccc(OC)cc3)n2)cc1 | CS(=O)(=O)c1ccc(-c2ccnc(Nc3cccc(S(N)(=O)=O)c3)n2)cc1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.635542 |
COc1ccc(-c2ccnc(Nc3ccc(C(N)=O)cc3)n2)cc1 | CS(=O)(=O)c1ccc(-c2ccnc(Nc3cccc(S(N)(=O)=O)c3)n2)cc1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.635671 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2ccccc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.665266 |
O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.724744 |
Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.812834 |
O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.661146 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2cc(Cl)cc(Cl)c2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.756649 |
O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | O=c1[nH]c2cc(Cl)cc(Cl)c2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.743628 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c2cc(Cl)cc(Cl)c2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.730524 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.789474 |
Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.747748 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.675462 |
CCCOc1cc(/C=C/c2ccccc2)oc(=O)c1 | COc1cc(/C=C/c2ccc(C(F)(F)F)cc2)oc(=O)c1 | O=c1cccc(/C=C/c2ccccc2)o1 | 0.831169 |
COc1cc(/C=C/c2ccccc2)oc(=O)c1C | COc1cc(/C=C/c2ccc(C(F)(F)F)cc2)oc(=O)c1 | O=c1cccc(/C=C/c2ccccc2)o1 | 0.759082 |
CCOc1cc(/C=C/c2ccccc2)oc(=O)c1 | COc1cc(/C=C/c2ccc(C(F)(F)F)cc2)oc(=O)c1 | O=c1cccc(/C=C/c2ccccc2)o1 | 0.847345 |
CCCOc1cc(/C=C/c2ccccc2)oc(=O)c1 | COc1cc(/C=C/c2ccc(C(C)(C)C)cc2)oc(=O)c1 | O=c1cccc(/C=C/c2ccccc2)o1 | 0.839479 |
O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | O=c1[nH]c2cc(Cl)c(Cl)cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.758833 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c2cc(Cl)c(Cl)cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.718509 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c2cc(Cl)ccc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.720588 |
O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c2cc(Cl)ccc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.674731 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2cc(Cl)ccc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.754902 |
Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.842593 |
O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.767802 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.783422 |
O=c1[nH]c2cc(Cl)cc(Cl)c2c(=O)n1O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.835385 |
O=c1[nH]c2cc(Cl)c([N+](=O)[O-])cc2c(=O)n1O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.773109 |
O=c1[nH]c2cc(Cl)c(Cl)cc2c(=O)n1O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.865079 |
O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.67487 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | COn1c(=O)[nH]c2cc(Cl)ccc2c1=O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.752022 |
O=c1[nH]c2cc(Cl)c(Cl)cc2c(=O)n1O | O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.724088 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2ccc(Cl)cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.675639 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c2ccc(Cl)cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.661039 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.716184 |
Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.739418 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.772229 |
O=c1[nH]c2cc(Cl)cc(Cl)c2c(=O)n1O | O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.67602 |
O=c1[nH]c2cc(Cl)c(Cl)cc2c(=O)n1O | O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.680934 |
O=c1[nH]c2ccc(Cl)cc2c(=O)n1O | O=c1[nH]c2cc(C(F)(F)F)c([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.679783 |
O=C(O)CCC(=O)Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.722955 |
Nc1cc2c(=O)n(O)c(=O)[nH]c2cc1Cl | O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.812689 |
O=c1[nH]c2cc(C(F)(F)F)ccc2c(=O)n1O | O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.755352 |
O=C(O)COn1c(=O)[nH]c2cc(Cl)c([N+](=O)[O-])cc2c1=O | O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.791444 |
O=c1[nH]c2cc(Cl)cc(Cl)c2c(=O)n1O | O=c1[nH]c2ccc([N+](=O)[O-])cc2c(=O)n1O | O=c1[nH]c(=O)c2ccccc2[nH]1 | 0.72518 |
COc1cccc(-c2ccnc(Nc3cccc(S(N)(=O)=O)c3)n2)c1 | CC(=O)Nc1ccc(-c2ccnc(Nc3cccc(C(N)=O)c3)n2)cc1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.617816 |
COc1cccc(-c2ccnc(Nc3cccc(S(N)(=O)=O)c3)n2)c1 | COC(=O)c1ccc(Nc2nccc(-c3ccc(OC)cc3)n2)cc1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.674277 |
COc1ccc(-c2ccnc(Nc3ccc(C(=O)O)cc3)n2)cc1 | CS(=O)(=O)c1ccc(-c2ccnc(Nc3cccc(S(N)(=O)=O)c3)n2)cc1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.640673 |
COc1ccc(-c2ccnc(Nc3ccc(C(=O)O)cc3)n2)cc1 | NS(=O)(=O)c1cccc(Nc2nccc(-c3ccccc3)n2)c1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.663961 |
COc1ccc(-c2ccnc(Nc3ccc(C(=O)O)cc3)n2)cc1 | COc1cccc(-c2ccnc(Nc3cccc(S(N)(=O)=O)c3)n2)c1 | c1ccc(Nc2nccc(-c3ccccc3)n2)cc1 | 0.674884 |
Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)cc1 | CC(=O)c1ccccc1-c1nnc(Cc2nc3ccccc3[nH]2)o1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.735724 |
Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)cc1 | COc1cccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)c1OC | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.713914 |
COc1cccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)c1OC | Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)c(Cl)c1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.707975 |
Fc1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)c(Cl)c1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.777618 |
Oc1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)c(Cl)c1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.763195 |
Cc1nc2nccnc2cc1NC(=O)c1ccc([N+](=O)[O-])cc1 | COc1cc(C(=O)Nc2cc3nccnc3nc2C)cc(OC)c1OC | O=C(Nc1cnc2nccnc2c1)c1ccccc1 | 0.836 |
Cc1cc2[nH]c3nc(N)nc(NCc4ccc(Cl)cc4)c3c2cc1O | C[C@@H](Nc1nc(N)nc2[nH]c3ccc(O)cc3c12)c1ccccc1 | c1ccc(CNc2ncnc3[nH]c4ccccc4c23)cc1 | 0.89313 |
Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)c(Cl)c1 | COc1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.756303 |
Cc1cc2[nH]c3nc(N)nc(NCc4ccc(Cl)cc4)c3c2cc1O | C[C@H](Nc1nc(N)nc2[nH]c3ccc(O)cc3c12)c1ccccc1 | c1ccc(CNc2ncnc3[nH]c4ccccc4c23)cc1 | 0.89313 |
Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)c(Cl)c1 | CC(=O)c1ccccc1-c1nnc(Cc2nc3ccccc3[nH]2)o1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.732748 |
Cc1cc(N(C)C)nc(Cl)n1 | Cc1cc(NCCN)nc(Cl)n1 | c1cncnc1 | 0.759644 |
COc1ccc(CNc2cc(C)nc(Cl)n2)cc1 | Cc1cc(NCc2ccccc2)nc(NCCN(C)C)n1 | c1ccc(CNc2ccncn2)cc1 | 0.601869 |
Cc1cc(N(C)C)nc(Cl)n1 | CCNc1cc(C)nc(Cl)n1 | c1cncnc1 | 0.805031 |
c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | Clc1ccc(-c2nnc(Cc3nc4ccc(Cl)cc4[nH]3)o2)c(Cl)c1 | c1ccc(-c2nnc(Cc3nc4ccccc4[nH]3)o2)cc1 | 0.779412 |
Cc1nc2nccnc2cc1NC(=O)c1cccc(C(F)(F)F)c1 | COc1cc(C(=O)Nc2cc3nccnc3nc2C)cc(OC)c1OC | O=C(Nc1cnc2nccnc2c1)c1ccccc1 | 0.837981 |
Cc1cc(N(C)C)nc(Cl)n1 | CCCNc1cc(C)nc(Cl)n1 | c1cncnc1 | 0.761905 |
CCCNc1nc(C)cc(Cl)n1 | Cc1cc(Cl)nc(N(C)C)n1 | c1cncnc1 | 0.811258 |
CCNc1nc(C)cc(Cl)n1 | Cc1cc(Cl)nc(N(C)C)n1 | c1cncnc1 | 0.850174 |
Cc1cc(Cl)nc(NCCN)n1 | Cc1cc(Cl)nc(N(C)C)n1 | c1cncnc1 | 0.822148 |
Cc1cc(NCCN(C)C)nc(NCc2ccccc2)n1 | COc1ccc(CNc2nc(C)cc(Cl)n2)cc1 | c1ccc(CNc2ncccn2)cc1 | 0.513011 |
O=C(O)c1cc2cc(Cl)ccc2oc1=O | N#Cc1cc2cc(Br)cc(Br)c2oc1=O | O=c1ccc2ccccc2o1 | 0.596519 |
N#Cc1cc2cc(Cl)cc(Cl)c2oc1=O | N#Cc1cc2ccccc2oc1=O | O=c1ccc2ccccc2o1 | 0.766734 |
N#Cc1cc2cc(Cl)cc(Cl)c2oc1=O | O=C(O)c1cc2cc(Br)c(O)cc2oc1=O | O=c1ccc2ccccc2o1 | 0.555718 |
N#Cc1cc2ccccc2oc1=O | O=C(O)c1cc2cc(Br)c(O)cc2oc1=O | O=c1ccc2ccccc2o1 | 0.566225 |
N#Cc1cc2ccccc2oc1=O | N#Cc1cc2cc(Br)cc(Br)c2oc1=O | O=c1ccc2ccccc2o1 | 0.747036 |
N#Cc1cc2ccccc2oc1=O | O=C(O)c1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.56406 |
O=C(O)c1cc2cc(Br)c(O)cc2oc1=O | N#Cc1cc2cc(Cl)ccc2oc1=O | O=c1ccc2ccccc2o1 | 0.56025 |
N#Cc1cc2cc(Br)c(O)cc2oc1=O | O=C(O)c1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.560761 |
O=C(O)c1cc2cc(Cl)ccc2oc1=O | N#Cc1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.662771 |
O=C(O)c1cc2cc(Cl)ccc2oc1=O | N#Cc1cc2ccccc2oc1=O | O=c1ccc2ccccc2o1 | 0.610603 |
O=C(O)c1cc2cc(Br)c(O)cc2oc1=O | N#Cc1cc2cc(Br)cc(Br)c2oc1=O | O=c1ccc2ccccc2o1 | 0.642202 |
N#Cc1cc2cc(Cl)ccc2oc1=O | O=C(O)c1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.648918 |
N#Cc1cc2cc(Br)cc(Br)c2oc1=O | O=C(O)c1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.582222 |
CCCOc1cc(/C=C/c2ccccc2)oc(=O)c1 | COc1ccc(/C=C/c2cc(OC)cc(=O)o2)cc1 | O=c1cccc(/C=C/c2ccccc2)o1 | 0.866516 |
COc1cc(/C=C/c2ccccc2)oc(=O)c1C | COc1ccc(/C=C/c2cc(OC)cc(=O)o2)cc1 | O=c1cccc(/C=C/c2ccccc2)o1 | 0.752437 |
N#Cc1cc2cc(Cl)ccc2oc1=O | N#Cc1cc2cc(Br)cc(Br)c2oc1=O | O=c1ccc2ccccc2o1 | 0.725092 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | O=C(O)c1cc2cc(Cl)ccc2oc1=O | O=c1ccc2ccccc2o1 | 0.566064 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | N#Cc1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.61039 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | N#Cc1cc2ccccc2oc1=O | O=c1ccc2ccccc2o1 | 0.606742 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | O=C(O)c1cc2cc(Br)c(O)cc2oc1=O | O=c1ccc2ccccc2o1 | 0.716138 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | N#Cc1cc2cc(Cl)ccc2oc1=O | O=c1ccc2ccccc2o1 | 0.611026 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | O=C(O)c1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.577896 |
COc1c(Br)cc2cc(C(=O)O)c(=O)oc2c1Br | COc1c(Br)cc2cc(C#N)c(=O)oc2c1[N+](=O)[O-] | O=c1ccc2ccccc2o1 | 0.707118 |
O=C(O)c1cc2cc(Br)cc(Br)c2oc1=O | O=C(O)c1cc2cc(Cl)ccc2oc1=O | O=c1ccc2ccccc2o1 | 0.777963 |
O=C(O)c1cc2cc(Br)cc(Br)c2oc1=O | N#Cc1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.562963 |
O=C(O)c1cc2cc(Br)cc(Br)c2oc1=O | N#Cc1cc2ccccc2oc1=O | O=c1ccc2ccccc2o1 | 0.561462 |
O=C(O)c1cc2cc(Br)cc(Br)c2oc1=O | N#Cc1cc2cc(Cl)ccc2oc1=O | O=c1ccc2ccccc2o1 | 0.565561 |
COc1c(Br)cc2cc(C#N)c(=O)oc2c1Br | O=C(O)c1cc2cc(Br)c(O)c(Br)c2oc1=O | O=c1ccc2ccccc2o1 | 0.811511 |
COc1c(Br)cc2cc(C(=O)O)c(=O)oc2c1Br | N#Cc1cc2cc(Br)c(O)cc2oc1=O | O=c1ccc2ccccc2o1 | 0.68732 |
COc1c(Br)cc2cc(C(=O)O)c(=O)oc2c1Br | O=C(O)c1cc2cc(Cl)ccc2oc1=O | O=c1ccc2ccccc2o1 | 0.681034 |
COc1c(Br)cc2cc(C(=O)O)c(=O)oc2c1Br | N#Cc1cc2cc(Cl)cc(Cl)c2oc1=O | O=c1ccc2ccccc2o1 | 0.544607 |
Subsets and Splits