Molecule ID: mol14515
SMILES: c1cc(C2CCCN2)nc(C2CCCN2)c1
InChI: InChI=1S/C13H19N3/c1-4-12(10-6-2-8-14-10)16-13(5-1)11-7-3-9-15-11/h1,4-5,10-11,14-15H,2-3,6-9H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.46 | Datawarrior | 1 » 0 |
| 9.46 | QSARToolbox | 1 » 0 |
| 9.78 | OCHEM | 1 » 0 |
| 10.12 | Datawarrior | 1 » 0 |