Molecule ID: mol14839
SMILES: Cc1ccc(-c2cnc(-c3ccccc3)o2)cc1
InChI: InChI=1S/C16H13NO/c1-12-7-9-13(10-8-12)15-11-17-16(18-15)14-5-3-2-4-6-14/h2-11H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.91 | Datawarrior | 1 » 0 |
| 0.91 | QSARToolbox | 1 » 0 |
| 0.91 | OCHEM | 1 » 0 |