Molecule ID: mol28898
SMILES: CCOCP(=O)(O)O
InChI: InChI=1S/C3H9O4P/c1-2-7-3-8(4,5)6/h2-3H2,1H3,(H2,4,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.57 | AttenGpKa training set | 0 » -1 |
| 7.02 | QSARToolbox | -1 » -2 |
| 7.02 | AttenGpKa training set | -1 » -2 |