Molecule ID: mol28939
SMILES: CCc1ccccc1P(=O)(O)O
InChI: InChI=1S/C8H11O3P/c1-2-7-5-3-4-6-8(7)12(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.11 | AttenGpKa training set | 0 » -1 |
| 8.09 | AttenGpKa training set | -1 » -2 |