Molecule ID: mol30592
SMILES: Oc1cc(O)c2ccccc2c1O
InChI: InChI=1S/C10H8O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,11-13H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.00 | AttenGpKa training set | -1 » -2 |
| 11.00 | AttenGpKa training set | -2 » -3 |