Molecule ID: mol2238
SMILES: COc1ccc([P@@H](=O)O)cc1
InChI: InChI=1S/C7H9O3P/c1-10-6-2-4-7(5-3-6)11(8)9/h2-5,11H,1H3,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.75 | QSARToolbox | 0 » -1 |
| 2.35 | QSARToolbox | 0 » -1 |
| 2.35 | Hunt | 0 » -1 |
| 2.35 | OCHEM | 0 » -1 |