Molecule ID: mol28999
SMILES: O=P(O)(O)c1ccccc1-c1ccccc1
InChI: InChI=1S/C12H11O3P/c13-16(14,15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H,(H2,13,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.13 | OCHEM | -1 » -2 |
| 8.13 | AttenGpKa training set | -1 » -2 |
| 8.13 | QSARToolbox | -1 » -2 |