Molecule ID: mol15692
SMILES: CC(=O)Oc1cccc2cccc(O)c12
InChI: InChI=1S/C12H10O3/c1-8(13)15-11-7-3-5-9-4-2-6-10(14)12(9)11/h2-7,14H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.69 | QSARToolbox | 0 » -1 |
| 9.69 | QSARToolbox | 0 » -1 |
| 9.69 | OCHEM | 0 » -1 |
| 9.69 | Datawarrior | 0 » -1 |
| 9.69 | AttenGpKa training set | 0 » -1 |