Molecule ID: mol12861
SMILES: O=C(O)[C@H](P)CC[C@H](P)C(=O)O
InChI: InChI=1S/C6H12O4P2/c7-5(8)3(11)1-2-4(12)6(9)10/h3-4H,1-2,11-12H2,(H,7,8)(H,9,10)/t3-,4+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.54 | QSARToolbox | 0 » -1 |
| 3.54 | Datawarrior | 0 » -1 |
| 4.49 | Datawarrior | 0 » -1 |