Molecule ID: mol15082
SMILES: Cc1ccccc1C(=NCCCN(C)C)c1ccccc1C
InChI: InChI=1S/C20H26N2/c1-16-10-5-7-12-18(16)20(21-14-9-15-22(3)4)19-13-8-6-11-17(19)2/h5-8,10-13H,9,14-15H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.30 | Datawarrior | 2 » 1 |
| 4.30 | QSARToolbox | 2 » 1 |
| 8.70 | OCHEM | 1 » 0 |
| 8.70 | Datawarrior | 1 » 0 |