Molecule ID: mol7285
SMILES: Cc1nc(N)nc(N)c1C
InChI: InChI=1S/C6H10N4/c1-3-4(2)9-6(8)10-5(3)7/h1-2H3,(H4,7,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.07 | IUPAC digitized pKa | 1 » 0 |
| 8.07 | OCHEM | 1 » 0 |
| 8.07 | AttenGpKa training set | 1 » 0 |
| 8.70 | QSARToolbox | 1 » 0 |