Molecule ID: mol5157
SMILES: CN1CCC=C(C(=O)O)C1
InChI: InChI=1S/C7H11NO2/c1-8-4-2-3-6(5-8)7(9)10/h3H,2,4-5H2,1H3,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.07 | QSARToolbox | 0 » -1 |
| 9.07 | QSARToolbox | 0 » -1 |
| 9.07 | OCHEM | 0 » -1 |
| 9.07 | IUPAC digitized pKa | 0 » -1 |
| 9.07 | Datawarrior | 0 » -1 |
| 9.07 | OCHEM | 0 » -1 |
| 9.07 | OCHEM | 0 » -1 |
| 9.07 | OCHEM | 0 » -1 |