Molecule ID: mol9432
SMILES: CN(CC(=O)O)CC(=O)O
InChI: InChI=1S/C5H9NO4/c1-6(2-4(7)8)3-5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.12 | IUPAC digitized pKa | 0 » -1 |
| 2.14 | IUPAC digitized pKa | 0 » -1 |
| 2.14 | IUPAC digitized pKa | 0 » -1 |
| 2.15 | IUPAC digitized pKa | 0 » -1 |
| 2.15 | IUPAC digitized pKa | 0 » -1 |
| 2.15 | OCHEM | 0 » -1 |
| 2.15 | OCHEM | 0 » -1 |
| 2.15 | OCHEM | 0 » -1 |
| 2.15 | QSARToolbox | 0 » -1 |
| 2.15 | IUPAC digitized pKa | 0 » -1 |
| 2.81 | AttenGpKa training set | 0 » -1 |
| 9.57 | IUPAC digitized pKa | -1 » -2 |
| 9.57 | OCHEM | -1 » -2 |
| 9.65 | IUPAC digitized pKa | -1 » -2 |
| 9.76 | QSARToolbox | -1 » -2 |
| 9.76 | IUPAC digitized pKa | -1 » -2 |
| 9.92 | IUPAC digitized pKa | -1 » -2 |
| 10.09 | IUPAC digitized pKa | -1 » -2 |
| 10.18 | AttenGpKa training set | -1 » -2 |
| 10.29 | IUPAC digitized pKa | -1 » -2 |
| 10.47 | IUPAC digitized pKa | -1 » -2 |