Molecule ID: mol12773
SMILES: C1CCN(N2CCCCC2)CC1
InChI: InChI=1S/C10H20N2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.09 | Datawarrior | 2 » 1 |
| 7.09 | AttenGpKa training set | 2 » 1 |
| 7.09 | QSARToolbox | 2 » 1 |
| 7.09 | OCHEM | 2 » 1 |