Molecule ID: mol6382
SMILES: NCCCNCc1ccccn1
InChI: InChI=1S/C9H15N3/c10-5-3-6-11-8-9-4-1-2-7-12-9/h1-2,4,7,11H,3,5-6,8,10H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.10 | IUPAC digitized pKa | 3 » 2 |
| 7.50 | IUPAC digitized pKa | 2 » 1 |
| 10.09 | IUPAC digitized pKa | 1 » 0 |