Molecule name stringlengths 12 12 | SMILES stringlengths 32 101 | HLM float64 0 1.62k |
|---|---|---|
ASAP-0014769 | C[C@H]1CN(C2=CN=CC3=CC=CC=C23)C(=O)[C@@]12CN(CC1=NN(C)C=N1)C(=O)C1=CC=C(F)C=C12 | 3 |
ASAP-0014764 | C[C@H]1CN(C2=CN=CC3=CC=CC=C23)C(=O)[C@@]12CN(CC1=NOC=C1)C(=O)C1=CC=C(F)C=C12 | 53 |
ASAP-0014770 | C[C@H]1CN(C2=CN=CC3=CC=CC=C23)C(=O)[C@@]12CN(CC1=NN(C)C=C1)C(=O)C1=CC=C(F)C=C12 | 85 |
ASAP-0014773 | C[C@H]1CN(C2=CN=CC3=CC=CC=C23)C(=O)[C@@]12CN(CC1=CN(C)N=C1)C(=O)C1=CC=C(F)C=C12 | 48 |
ASAP-0014789 | COC[C@H]1CN(C2=CN=CC3=CC=CC=C23)C(=O)[C@@]12CN(CC1=CC=NN1)C(=O)C1=CC=C(Cl)C=C12 | 156 |
ASAP-0014632 | C[C@H]1CN(C2=CN=CC3=CC=CC=C23)C(=O)[C@@]12CN(CCN1CCCC1=O)C(=O)C1=CC=C(Cl)C=C12 | 406 |
ASAP-0014619 | CC1=NC=C(CN2C[C@@]3(C(=O)N(C4=CN=CC5=CC=CC=C45)C[C@@H]3C)C3=CC(F)=CC=C3C2=O)O1 | 143 |
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