Molecule ID: mol11476
SMILES: C[N+](C)(C)Cc1cccc(O)c1
InChI: InChI=1S/C10H15NO/c1-11(2,3)8-9-5-4-6-10(12)7-9/h4-7H,8H2,1-3H3/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.89 | IUPAC digitized pKa | 1 » 0 |
| 8.89 | Datawarrior | 1 » 0 |
| 8.89 | AttenGpKa training set | 1 » 0 |
| 8.89 | OCHEM | 1 » 0 |
| 8.89 | QSARToolbox | 1 » 0 |