Molecule ID: mol15378
SMILES: Cc1ccccc1C(=NCCCN(C)C)c1ccccc1
InChI: InChI=1S/C19H24N2/c1-16-10-7-8-13-18(16)19(17-11-5-4-6-12-17)20-14-9-15-21(2)3/h4-8,10-13H,9,14-15H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.29 | QSARToolbox | 2 » 1 |
| 4.29 | Datawarrior | 2 » 1 |
| 9.00 | Datawarrior | 1 » 0 |
| 9.00 | OCHEM | 1 » 0 |