Molecule ID: mol14535
SMILES: NS(=O)(=O)c1nnc(Nc2ccccc2)s1
InChI: InChI=1S/C8H8N4O2S2/c9-16(13,14)8-12-11-7(15-8)10-6-4-2-1-3-5-6/h1-5H,(H,10,11)(H2,9,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.70 | OCHEM | 0 » -1 |
| 7.70 | Datawarrior | 0 » -1 |
| 11.11 | Datawarrior | -1 » -2 |