Molecule ID: mol5407
SMILES: NC(=O)[C@@H](N)CC(=O)O
InChI: InChI=1S/C4H8N2O3/c5-2(4(6)9)1-3(7)8/h2H,1,5H2,(H2,6,9)(H,7,8)/t2-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.97 | IUPAC digitized pKa | 1 » 0 |
| 2.97 | QSARToolbox | 1 » 0 |
| 7.95 | IUPAC digitized pKa | 0 » -1 |
| 8.02 | IUPAC digitized pKa | 0 » -1 |