Molecule ID: mol5344
SMILES: NCCC(N)C(=O)O
InChI: InChI=1S/C4H10N2O2/c5-2-1-3(6)4(7)8/h3H,1-2,5-6H2,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.85 | IUPAC digitized pKa | 2 » 1 |
| 1.85 | IUPAC digitized pKa | 2 » 1 |
| 1.85 | QSARToolbox | 2 » 1 |
| 1.85 | QSARToolbox | 2 » 1 |
| 4.00 | OCHEM | 2 » 1 |
| 4.00 | Baltruschat ChEMBL | 2 » 1 |
| 8.24 | QSARToolbox | 1 » 0 |
| 8.24 | IUPAC digitized pKa | 1 » 0 |
| 8.28 | IUPAC digitized pKa | 1 » 0 |
| 10.44 | QSARToolbox | 0 » -1 |
| 10.44 | IUPAC digitized pKa | 0 » -1 |
| 10.50 | IUPAC digitized pKa | 0 » -1 |