Molecule ID: mol9523
SMILES: O=c1c(O)c(O)c(=O)c(=O)c1=O
InChI: InChI=1S/C6H2O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h7-8H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.77 | AttenGpKa training set | 0 » -1 |
| 4.10 | IUPAC digitized pKa | 0 » -1 |
| 4.25 | IUPAC digitized pKa | 0 » -1 |
| 4.50 | IUPAC digitized pKa | 0 » -1 |
| 4.72 | IUPAC digitized pKa | 0 » -1 |
| 4.78 | AttenGpKa training set | 0 » -1 |
| 5.06 | IUPAC digitized pKa | 0 » -1 |