Molecule ID: mol8353
SMILES: Oc1ncnc2[nH]nnc12
InChI: InChI=1S/C4H3N5O/c10-4-2-3(5-1-6-4)8-9-7-2/h1H,(H2,5,6,7,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.60 | IUPAC digitized pKa | 2 » 1 |
| 5.19 | IUPAC digitized pKa | 0 » -1 |
| 10.83 | IUPAC digitized pKa | -1 » -2 |