Molecule ID: mol16618
SMILES: COCCOCCNC(C)c1cc2cc(S(N)(=O)=O)sc2s1
InChI: InChI=1S/C13H20N2O4S3/c1-9(15-3-4-19-6-5-18-2)11-7-10-8-12(22(14,16)17)21-13(10)20-11/h7-9,15H,3-6H2,1-2H3,(H2,14,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.13 | OCHEM | 1 » 0 |
| 7.13 | Baltruschat ChEMBL | 1 » 0 |