Molecule ID: mol29383
SMILES: O=S(=O)(O)CCCNC(CO)(CO)CO
InChI: InChI=1S/C7H17NO6S/c9-4-7(5-10,6-11)8-2-1-3-15(12,13)14/h8-11H,1-6H2,(H,12,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.40 | AttenGpKa training set | 0 » -1 |
| 8.61 | QSARToolbox | 0 » -1 |
| 8.64 | QSARToolbox | 0 » -1 |
| 8.66 | QSARToolbox | 0 » -1 |
| 8.68 | QSARToolbox | 0 » -1 |
| 8.71 | QSARToolbox | 0 » -1 |
| 8.71 | QSARToolbox | 0 » -1 |
| 8.72 | QSARToolbox | 0 » -1 |
| 8.82 | QSARToolbox | 0 » -1 |
| 8.94 | QSARToolbox | 0 » -1 |