Molecule ID: mol9659
SMILES: Nc1[nH]c(=O)c(C(=O)O)nc1C=O
InChI: InChI=1S/C6H5N3O4/c7-4-2(1-10)8-3(6(12)13)5(11)9-4/h1H,(H,12,13)(H3,7,9,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.71 | IUPAC digitized pKa | 0 » -1 |
| 7.63 | IUPAC digitized pKa | -1 » -2 |