Molecule ID: mol16004
SMILES: O=C(O)C1CCC1
InChI: InChI=1S/C5H8O2/c6-5(7)4-2-1-3-4/h4H,1-3H2,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.78 | OCHEM | 0 » -1 |
| 4.78 | OCHEM | 0 » -1 |
| 4.78 | AttenGpKa training set | 0 » -1 |
| 4.79 | QSARToolbox | 0 » -1 |
| 4.79 | QSARToolbox | 0 » -1 |
| 4.79 | QSARToolbox | 0 » -1 |
| 4.79 | Datawarrior | 0 » -1 |
| 4.79 | OCHEM | 0 » -1 |
| 4.79 | OCHEM | 0 » -1 |
| 7.23 | QSARToolbox | 0 » -1 |