Molecule ID: mol2111
SMILES: Cc1ccccc1/C=C/c1ccc(N(C)C)cc1
InChI: InChI=1S/C17H19N/c1-14-6-4-5-7-16(14)11-8-15-9-12-17(13-10-15)18(2)3/h4-13H,1-3H3/b11-8+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.59 | Datawarrior | 1 » 0 |
| 4.59 | QSARToolbox | 1 » 0 |
| 4.67 | Hunt | 1 » 0 |