Molecule ID: mol13275
SMILES: CC(=O)c1ccc(O)c(CN(C)C)c1
InChI: InChI=1S/C11H15NO2/c1-8(13)9-4-5-11(14)10(6-9)7-12(2)3/h4-6,14H,7H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.62 | AttenGpKa training set | 1 » 0 |
| 10.00 | Datawarrior | 0 » -1 |
| 10.00 | OCHEM | 0 » -1 |