Molecule ID: mol9162
SMILES: Cc1nc(=O)[nH]c(=O)[nH]1
InChI: InChI=1S/C4H5N3O2/c1-2-5-3(8)7-4(9)6-2/h1H3,(H2,5,6,7,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.21 | IUPAC digitized pKa | 0 » -1 |
| 7.21 | AttenGpKa training set | 0 » -1 |
| 7.23 | IUPAC digitized pKa | 0 » -1 |