Molecule ID: mol22366
SMILES: O=C(O)/C=C/C=C/C=C/C(=O)O
InChI: InChI=1S/C8H8O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H,(H,9,10)(H,11,12)/b2-1+,5-3+,6-4+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.01 | AttenGpKa training set | 0 » -1 |
| 6.59 | AttenGpKa training set | 0 » -1 |