Molecule ID: mol9805
SMILES: CCN(CC(=O)O)CC(=O)O
InChI: InChI=1S/C6H11NO4/c1-2-7(3-5(8)9)4-6(10)11/h2-4H2,1H3,(H,8,9)(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.55 | IUPAC digitized pKa | 0 » -1 |
| 2.70 | QSARToolbox | 0 » -1 |
| 2.70 | QSARToolbox | 0 » -1 |
| 8.56 | IUPAC digitized pKa | -1 » -2 |