Molecule ID: mol17306
SMILES: NS(=O)(=O)c1nn2c(=O)n(CCCl)c(=O)nc2s1
InChI: InChI=1S/C6H6ClN5O4S2/c7-1-2-11-3(13)9-4-12(6(11)14)10-5(17-4)18(8,15)16/h1-2H2,(H2,8,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.10 | OCHEM | 0 » -1 |
| 7.10 | Baltruschat ChEMBL | 0 » -1 |