Molecule ID: mol13524
SMILES: CN(C)CCNCCN
InChI: InChI=1S/C6H17N3/c1-9(2)6-5-8-4-3-7/h8H,3-7H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.36 | Datawarrior | 3 » 2 |
| 4.36 | QSARToolbox | 3 » 2 |
| 9.12 | Datawarrior | 2 » 1 |
| 9.91 | OCHEM | 1 » 0 |
| 9.91 | Datawarrior | 1 » 0 |