Molecule ID: mol14307
SMILES: CCN(CC)CC(=O)Nc1ccccc1
InChI: InChI=1S/C12H18N2O/c1-3-14(4-2)10-12(15)13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,13,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.00 | Datawarrior | 1 » 0 |
| 8.00 | OCHEM | 1 » 0 |
| 8.00 | QSARToolbox | 1 » 0 |
| 8.03 | QSARToolbox | 1 » 0 |
| 8.12 | QSARToolbox | 1 » 0 |