Molecule ID: mol17023
SMILES: CN1C=CN(C2OC(C(Cl)(Cl)Cl)=CN2c2ccc(S(N)(=O)=O)cc2)C=C1
InChI: InChI=1S/C15H15Cl3N4O3S/c1-20-6-8-21(9-7-20)14-22(10-13(25-14)15(16,17)18)11-2-4-12(5-3-11)26(19,23)24/h2-10,14H,1H3,(H2,19,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.55 | Baltruschat ChEMBL | 0 » -1 |