Molecule ID: mol15936
SMILES: C=CCCC(=O)O
InChI: InChI=1S/C5H8O2/c1-2-3-4-5(6)7/h2H,1,3-4H2,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.67 | QSARToolbox | 0 » -1 |
| 4.68 | OCHEM | 0 » -1 |
| 4.68 | OCHEM | 0 » -1 |
| 4.68 | QSARToolbox | 0 » -1 |
| 4.68 | QSARToolbox | 0 » -1 |
| 4.68 | QSARToolbox | 0 » -1 |
| 4.68 | Datawarrior | 0 » -1 |
| 4.68 | OCHEM | 0 » -1 |
| 4.68 | OCHEM | 0 » -1 |
| 4.68 | AttenGpKa training set | 0 » -1 |
| 4.70 | QSARToolbox | 0 » -1 |
| 4.70 | QSARToolbox | 0 » -1 |