Molecule ID: mol12077
SMILES: O=C1CC(c2ccccc2)(c2ccccc2)C(=O)N1
InChI: InChI=1S/C16H13NO2/c18-14-11-16(15(19)17-14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.25 | AttenGpKa training set | 0 » -1 |