Molecule ID: mol8352
SMILES: Oc1ncc2nn[nH]c2n1
InChI: InChI=1S/C4H3N5O/c10-4-5-1-2-3(6-4)8-9-7-2/h1H,(H2,5,6,7,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.61 | IUPAC digitized pKa | 2 » 1 |
| 6.56 | IUPAC digitized pKa | 0 » -1 |
| 10.21 | IUPAC digitized pKa | -1 » -2 |