Molecule ID: mol1332
SMILES: CN1CCN(C(=O)c2ccccc2)CC1
InChI: InChI=1S/C12H16N2O/c1-13-7-9-14(10-8-13)12(15)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.78 | Datawarrior | 1 » 0 |
| 6.78 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 6.78 | OCHEM | 1 » 0 |
| 6.78 | Hunt | 1 » 0 |
| 6.78 | OCHEM | 1 » 0 |
| 6.78 | OCHEM | 1 » 0 |