Molecule ID: mol9732
SMILES: O=C(O)CNc1cc[nH]c(=O)n1
InChI: InChI=1S/C6H7N3O3/c10-5(11)3-8-4-1-2-7-6(12)9-4/h1-2H,3H2,(H,10,11)(H2,7,8,9,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.40 | IUPAC digitized pKa | 0 » -1 |
| 12.60 | IUPAC digitized pKa | -1 » -2 |