Molecule ID: mol31214
SMILES: O/C(=C\[n+]1ccccc1)c1ccccc1
InChI: InChI=1S/C13H11NO/c15-13(12-7-3-1-4-8-12)11-14-9-5-2-6-10-14/h1-11H/p+1/b13-11-
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.80 | AttenGpKa training set | 1 » 0 |
| 4.80 | QSARToolbox | 1 » 0 |