Molecule ID: mol13550
SMILES: O=c1cccc(O)cc1
InChI: InChI=1S/C7H6O2/c8-6-2-1-3-7(9)5-4-6/h1-5,8H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.64 | QSARToolbox | 0 » -1 |
| 5.64 | OCHEM | 0 » -1 |
| 5.64 | Datawarrior | 0 » -1 |
| 5.64 | AttenGpKa training set | 0 » -1 |
| 5.65 | QSARToolbox | 0 » -1 |