Molecule ID: mol15799
SMILES: COc1cccc2c1-c1c(O)cccc1-2
InChI: InChI=1S/C13H10O2/c1-15-11-7-3-5-9-8-4-2-6-10(14)12(8)13(9)11/h2-7,14H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.15 | OCHEM | 0 » -1 |
| 9.15 | QSARToolbox | 0 » -1 |
| 9.15 | QSARToolbox | 0 » -1 |
| 9.15 | Datawarrior | 0 » -1 |
| 9.15 | AttenGpKa training set | 0 » -1 |