Molecule ID: mol15216
SMILES: Cc1ccnc(NS(=O)(=O)c2ccccc2)n1
InChI: InChI=1S/C11H11N3O2S/c1-9-7-8-12-11(13-9)14-17(15,16)10-5-3-2-4-6-10/h2-8H,1H3,(H,12,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.59 | OCHEM | 1 » 0 |
| 0.59 | Datawarrior | 1 » 0 |