Molecule ID: mol663
SMILES: COc1nn(C(=O)NS(=O)(=O)c2ccccc2OC(F)(F)F)c(=O)n1C
InChI: InChI=1S/C12H11F3N4O6S/c1-18-10(24-2)16-19(11(18)21)9(20)17-26(22,23)8-6-4-3-5-7(8)25-12(13,14)15/h3-6H,1-2H3,(H,17,20)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.90 | OCHEM | 1 » 0 |
| 1.90 | Hunt | 1 » 0 |