Molecule ID: mol20960
SMILES: NS(=O)(=O)c1ccc(S(=O)(=O)CCCO)c(C(=O)O)c1
InChI: InChI=1S/C10H13NO7S2/c11-20(17,18)7-2-3-9(8(6-7)10(13)14)19(15,16)5-1-4-12/h2-3,6,12H,1,4-5H2,(H,13,14)(H2,11,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.28 | Baltruschat ChEMBL | -1 » -2 |