Molecule ID: mol33014
SMILES: NCCCC(N)C(=O)O
InChI: InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.71 | QSARToolbox | 2 » 1 |
| 1.71 | QSARToolbox | 2 » 1 |
| 1.76 | QSARToolbox | 2 » 1 |
| 1.94 | OCHEM | 2 » 1 |
| 1.94 | QSARToolbox | 2 » 1 |
| 1.94 | QSARToolbox | 2 » 1 |
| 8.62 | QSARToolbox | 1 » 0 |
| 8.65 | QSARToolbox | 1 » 0 |
| 8.65 | OCHEM | 1 » 0 |
| 8.75 | QSARToolbox | 1 » 0 |
| 10.76 | OCHEM | 0 » -1 |