Molecule ID: mol18075
SMILES: CC(C)CNCc1cc2cc(S(N)(=O)=O)oc2s1
InChI: InChI=1S/C11H16N2O3S2/c1-7(2)5-13-6-9-3-8-4-10(18(12,14)15)16-11(8)17-9/h3-4,7,13H,5-6H2,1-2H3,(H2,12,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.55 | Baltruschat ChEMBL | 1 » 0 |
| 9.10 | Baltruschat ChEMBL | 0 » -1 |