Molecule ID: mol19472
SMILES: O=Cc1ccc(O)c2ncccc12
InChI: InChI=1S/C10H7NO2/c12-6-7-3-4-9(13)10-8(7)2-1-5-11-10/h1-6,13H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.00 | Baltruschat ChEMBL | 1 » 0 |
| 4.42 | Baltruschat ChEMBL | 1 » 0 |
| 7.01 | Baltruschat ChEMBL | 0 » -1 |