Molecule ID: mol32156
SMILES: CCc1cc(OCCc2ccc(C(=N)N)c(O)c2)cc(OS(=O)(=O)c2cc(Cl)cc(Cl)c2OC)c1
InChI: InChI=1S/C24H24Cl2N2O6S/c1-3-14-8-17(33-7-6-15-4-5-19(24(27)28)21(29)10-15)13-18(9-14)34-35(30,31)22-12-16(25)11-20(26)23(22)32-2/h4-5,8-13,29H,3,6-7H2,1-2H3,(H3,27,28)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.30 | OCHEM | 1 » 0 |
| 6.30 | QSARToolbox | 1 » 0 |