Molecule ID: mol12494
SMILES: CCNCCC(=O)O
InChI: InChI=1S/C5H11NO2/c1-2-6-4-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.61 | QSARToolbox | 1 » 0 |
| 3.61 | OCHEM | 1 » 0 |
| 3.61 | Datawarrior | 1 » 0 |
| 10.60 | Datawarrior | 0 » -1 |
| 10.60 | OCHEM | 0 » -1 |