Molecule ID: mol34066
SMILES: O=C1CC(=O)NCCNCCCNCCN1
InChI: InChI=1S/C10H20N4O2/c15-9-8-10(16)14-7-5-12-3-1-2-11-4-6-13-9/h11-12H,1-8H2,(H,13,15)(H,14,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.85 | QSARToolbox | 2 » 1 |
| 9.63 | QSARToolbox | 1 » 0 |