Molecule ID: mol28650
SMILES: Nc1c(S(=O)(=O)O)ccc2c1C(=O)c1ccccc1C2=O
InChI: InChI=1S/C14H9NO5S/c15-12-10(21(18,19)20)6-5-9-11(12)14(17)8-4-2-1-3-7(8)13(9)16/h1-6H,15H2,(H,18,19,20)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.79 | AttenGpKa training set | 0 » -1 |