Molecule ID: mol31955
SMILES: O=S(=O)(CCCOCCc1cc2ccccc2o1)CCNCCc1ccc(O)c2nc(O)sc12
InChI: InChI=1S/C24H28N2O6S2/c27-20-7-6-17(23-22(20)26-24(28)33-23)8-10-25-11-15-34(29,30)14-3-12-31-13-9-19-16-18-4-1-2-5-21(18)32-19/h1-2,4-7,16,25,27H,3,8-15H2,(H,26,28)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.00 | OCHEM | 0 » -1 |