Molecule ID: mol6353
SMILES: Nc1cc(C(=O)O)ccn1
InChI: InChI=1S/C6H6N2O2/c7-5-3-4(6(9)10)1-2-8-5/h1-3H,(H2,7,8)(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.95 | IUPAC digitized pKa | 1 » 0 |
| 6.37 | IUPAC digitized pKa | 0 » -1 |
| 6.37 | OCHEM | 0 » -1 |