Molecule ID: mol5469
SMILES: CN(CC(=O)O)C(=O)CN
InChI: InChI=1S/C5H10N2O3/c1-7(3-5(9)10)4(8)2-6/h2-3,6H2,1H3,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.33 | QSARToolbox | 1 » 0 |
| 2.57 | QSARToolbox | 1 » 0 |
| 2.57 | QSARToolbox | 1 » 0 |
| 2.76 | IUPAC digitized pKa | 1 » 0 |
| 2.90 | QSARToolbox | 1 » 0 |
| 2.98 | IUPAC digitized pKa | 1 » 0 |
| 8.54 | QSARToolbox | 0 » -1 |
| 8.55 | QSARToolbox | 0 » -1 |
| 8.57 | IUPAC digitized pKa | 0 » -1 |
| 8.58 | AttenGpKa training set | 0 » -1 |
| 8.59 | IUPAC digitized pKa | 0 » -1 |
| 8.61 | IUPAC digitized pKa | 0 » -1 |
| 8.77 | QSARToolbox | 0 » -1 |
| 8.80 | IUPAC digitized pKa | 0 » -1 |