Molecule ID: mol22758
SMILES: C[N+](C)(C)c1ccccc1C(=O)O
InChI: InChI=1S/C10H13NO2/c1-11(2,3)9-7-5-4-6-8(9)10(12)13/h4-7H,1-3H3/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.16 | QSARToolbox | 1 » 0 |
| 1.16 | OCHEM | 1 » 0 |
| 1.27 | AttenGpKa training set | 1 » 0 |
| 1.37 | QSARToolbox | 1 » 0 |