Molecule ID: mol10198
SMILES: COc1ccc(S(=O)O)cc1
InChI: InChI=1S/C7H8O3S/c1-10-6-2-4-7(5-3-6)11(8)9/h2-5H,1H3,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.70 | QSARToolbox | 0 » -1 |
| 1.70 | QSARToolbox | 0 » -1 |
| 1.70 | QSARToolbox | 0 » -1 |
| 2.72 | IUPAC digitized pKa | 0 » -1 |