Molecule ID: mol7625
SMILES: CNc1nc(N)nc(N)n1
InChI: InChI=1S/C4H8N6/c1-7-4-9-2(5)8-3(6)10-4/h1H3,(H5,5,6,7,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.10 | IUPAC digitized pKa | 1 » 0 |
| 5.10 | AttenGpKa training set | 1 » 0 |
| 8.72 | QSARToolbox | 1 » 0 |