Molecule ID: mol9640
SMILES: Nc1nc(=O)c2ncc(=O)[nH]c2[nH]1
InChI: InChI=1S/C6H5N5O2/c7-6-10-4-3(5(13)11-6)8-1-2(12)9-4/h1H,(H4,7,9,10,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.34 | IUPAC digitized pKa | 0 » -1 |
| 10.06 | IUPAC digitized pKa | -1 » -2 |