Molecule ID: mol5760
SMILES: O=C1C=CC(=Nc2ccc(O)cc2)C=C1
InChI: InChI=1S/C12H9NO2/c14-11-5-1-9(2-6-11)13-10-3-7-12(15)8-4-10/h1-8,14H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.10 | Datawarrior | 0 » -1 |
| 8.10 | QSARToolbox | 0 » -1 |
| 8.10 | OCHEM | 0 » -1 |