Molecule ID: mol493
SMILES: Cc1nn(-c2ccccc2)c(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)c1C#N
InChI: InChI=1S/C18H14ClN5O3S/c1-12-16(11-20)17(24(22-12)14-5-3-2-4-6-14)21-18(25)23-28(26,27)15-9-7-13(19)8-10-15/h2-10H,1H3,(H2,21,23,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.30 | Hunt | 0 » -1 |