Molecule ID: mol34027
SMILES: NCCC(O)(P(=O)(O)O)P(=O)(O)O
InChI: InChI=1S/C3H11NO7P2/c4-2-1-3(5,12(6,7)8)13(9,10)11/h5H,1-2,4H2,(H2,6,7,8)(H2,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.55 | QSARToolbox | 0 » -1 |
| 2.55 | QSARToolbox | 0 » -1 |
| 5.83 | QSARToolbox | -1 » -2 |