Molecule ID: mol8587
SMILES: O=S(=O)(O)CCNC(CO)(CO)CO
InChI: InChI=1S/C6H15NO6S/c8-3-6(4-9,5-10)7-1-2-14(11,12)13/h7-10H,1-5H2,(H,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.14 | IUPAC digitized pKa | 0 » -1 |
| 7.43 | AttenGpKa training set | 0 » -1 |
| 7.50 | IUPAC digitized pKa | 0 » -1 |
| 7.69 | QSARToolbox | 0 » -1 |
| 7.69 | QSARToolbox | 0 » -1 |
| 7.73 | QSARToolbox | 0 » -1 |
| 7.76 | QSARToolbox | 0 » -1 |
| 7.79 | QSARToolbox | 0 » -1 |
| 7.82 | QSARToolbox | 0 » -1 |
| 7.88 | QSARToolbox | 0 » -1 |
| 7.92 | IUPAC digitized pKa | 0 » -1 |