Molecule ID: mol16283
SMILES: Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1
InChI: InChI=1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,18H,1-2H3,(H,15,16,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.08 | OCHEM | 0 » -1 |
| 4.08 | Baltruschat ChEMBL | 0 » -1 |