Molecule ID: mol8441
SMILES: NC(=O)CNCCS(=O)(=O)O
InChI: InChI=1S/C4H10N2O4S/c5-4(7)3-6-1-2-11(8,9)10/h6H,1-3H2,(H2,5,7)(H,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.56 | IUPAC digitized pKa | 0 » -1 |
| 6.87 | AttenGpKa training set | 0 » -1 |
| 6.88 | IUPAC digitized pKa | 0 » -1 |
| 6.92 | QSARToolbox | 0 » -1 |
| 6.92 | QSARToolbox | 0 » -1 |
| 6.92 | QSARToolbox | 0 » -1 |
| 6.96 | QSARToolbox | 0 » -1 |
| 7.03 | QSARToolbox | 0 » -1 |
| 7.03 | QSARToolbox | 0 » -1 |
| 7.32 | IUPAC digitized pKa | 0 » -1 |