Molecule ID: mol24662
SMILES: CCCCCCN1CCN(c2ncccn2)CC1
InChI: InChI=1S/C14H24N4/c1-2-3-4-5-9-17-10-12-18(13-11-17)14-15-7-6-8-16-14/h6-8H,2-5,9-13H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.92 | QSARToolbox | 1 » 0 |
| 8.02 | AttenGpKa training set | 1 » 0 |