Molecule ID: mol28967
SMILES: O=P(O)(O)c1ccc2c(c1)OCO2
InChI: InChI=1S/C7H7O5P/c8-13(9,10)5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H2,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.15 | AttenGpKa training set | -1 » -2 |
| 7.15 | QSARToolbox | -1 » -2 |