Molecule ID: mol10406
SMILES: Cc1ccc(C(=O)O)cc1O
InChI: InChI=1S/C8H8O3/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,9H,1H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.10 | QSARToolbox | 0 » -1 |
| 4.32 | Datawarrior | 0 » -1 |
| 4.32 | OCHEM | 0 » -1 |
| 4.32 | QSARToolbox | 0 » -1 |
| 4.32 | QSARToolbox | 0 » -1 |
| 4.32 | OCHEM | 0 » -1 |