Molecule ID: mol2883
SMILES: CS(=O)(=O)c1ccc(-c2nc3c(c(=O)[nH]2)COCC3)cc1
InChI: InChI=1S/C14H14N2O4S/c1-21(18,19)10-4-2-9(3-5-10)13-15-12-6-7-20-8-11(12)14(17)16-13/h2-5H,6-8H2,1H3,(H,15,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.31 | Novartis | 0 » -1 |