Molecule ID: mol15083
SMILES: Cc1cccc(C)c1C(=NCCCN(C)C)c1ccccc1
InChI: InChI=1S/C20H26N2/c1-16-10-8-11-17(2)19(16)20(18-12-6-5-7-13-18)21-14-9-15-22(3)4/h5-8,10-13H,9,14-15H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.83 | QSARToolbox | 2 » 1 |
| 3.83 | Datawarrior | 2 » 1 |
| 8.70 | OCHEM | 1 » 0 |
| 8.70 | Datawarrior | 1 » 0 |