Molecule ID: mol14240
SMILES: Cc1ccc(N(C)CO)cc1
InChI: InChI=1S/C9H13NO/c1-8-3-5-9(6-4-8)10(2)7-11/h3-6,11H,7H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.73 | Datawarrior | 1 » 0 |
| 3.73 | OCHEM | 1 » 0 |
| 3.73 | AttenGpKa training set | 1 » 0 |
| 3.73 | QSARToolbox | 1 » 0 |