Molecule ID: mol12774
SMILES: C1CCN(C2CCNCC2)CC1
InChI: InChI=1S/C10H20N2/c1-2-8-12(9-3-1)10-4-6-11-7-5-10/h10-11H,1-9H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.97 | QSARToolbox | 2 » 1 |
| 7.97 | Datawarrior | 2 » 1 |
| 10.73 | Datawarrior | 1 » 0 |
| 10.73 | OCHEM | 1 » 0 |