Molecule ID: mol33742
SMILES: CSCCC(N)C(=O)O
InChI: InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.12 | QSARToolbox | 1 » 0 |
| 2.12 | QSARToolbox | 1 » 0 |
| 2.13 | QSARToolbox | 1 » 0 |
| 2.16 | QSARToolbox | 1 » 0 |
| 2.26 | QSARToolbox | 1 » 0 |
| 2.26 | QSARToolbox | 1 » 0 |
| 2.28 | QSARToolbox | 1 » 0 |
| 2.28 | QSARToolbox | 1 » 0 |
| 2.28 | QSARToolbox | 1 » 0 |
| 2.28 | QSARToolbox | 1 » 0 |
| 8.92 | QSARToolbox | 0 » -1 |
| 8.92 | QSARToolbox | 0 » -1 |
| 9.10 | QSARToolbox | 0 » -1 |
| 9.10 | QSARToolbox | 0 » -1 |
| 9.13 | QSARToolbox | 0 » -1 |
| 9.13 | QSARToolbox | 0 » -1 |
| 9.21 | QSARToolbox | 0 » -1 |
| 9.21 | QSARToolbox | 0 » -1 |