Molecule ID: mol8323
SMILES: Cn1cnc2cnc(N3CCCCC3)nc21
InChI: InChI=1S/C11H15N5/c1-15-8-13-9-7-12-11(14-10(9)15)16-5-3-2-4-6-16/h7-8H,2-6H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -0.38 | IUPAC digitized pKa | 2 » 1 |
| 4.10 | IUPAC digitized pKa | 1 » 0 |