Molecule ID: mol10174
SMILES: CCc1n[nH]c2nc(N)nc(=O)c-2n1
InChI: InChI=1S/C7H8N6O/c1-2-3-9-4-5(13-12-3)10-7(8)11-6(4)14/h2H2,1H3,(H3,8,10,11,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.15 | IUPAC digitized pKa | 1 » 0 |
| 7.00 | IUPAC digitized pKa | 0 » -1 |