Molecule ID: mol15186
SMILES: CC(=Nc1ccccc1O)c1ccccc1O
InChI: InChI=1S/C14H13NO2/c1-10(11-6-2-4-8-13(11)16)15-12-7-3-5-9-14(12)17/h2-9,16-17H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.64 | QSARToolbox | 1 » 0 |
| 4.96 | QSARToolbox | 1 » 0 |
| 5.14 | OCHEM | 1 » 0 |
| 5.14 | Datawarrior | 1 » 0 |
| 9.23 | OCHEM | 0 » -1 |
| 9.23 | Datawarrior | 0 » -1 |