Molecule ID: mol15243
SMILES: CCN(CC)CC(=O)Nc1ccc(C)cc1C
InChI: InChI=1S/C14H22N2O/c1-5-16(6-2)10-14(17)15-13-8-7-11(3)9-12(13)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.95 | OCHEM | 1 » 0 |
| 7.95 | QSARToolbox | 1 » 0 |
| 7.95 | Datawarrior | 1 » 0 |
| 8.04 | QSARToolbox | 1 » 0 |