Molecule ID: mol6354
SMILES: Nc1ccncc1NC(=O)C(=O)O
InChI: InChI=1S/C7H7N3O3/c8-4-1-2-9-3-5(4)10-6(11)7(12)13/h1-3H,(H2,8,9)(H,10,11)(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.37 | IUPAC digitized pKa | 1 » 0 |
| 8.09 | IUPAC digitized pKa | 0 » -1 |