Molecule ID: mol11475
SMILES: C[N+](C)(C)Cc1ccccc1O
InChI: InChI=1S/C10H15NO/c1-11(2,3)8-9-6-4-5-7-10(9)12/h4-7H,8H2,1-3H3/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.70 | QSARToolbox | 1 » 0 |
| 8.71 | Datawarrior | 1 » 0 |
| 8.71 | OCHEM | 1 » 0 |
| 8.74 | QSARToolbox | 1 » 0 |
| 8.74 | IUPAC digitized pKa | 1 » 0 |
| 8.74 | AttenGpKa training set | 1 » 0 |