Molecule ID: mol16387

SMILES: Cc1ccc(S(=O)(=O)c2cnc3ccc(F)cc3c2SCc2ccc(Cl)cc2)cc1

InChI: InChI=1S/C23H17ClFNO2S2/c1-15-2-9-19(10-3-15)30(27,28)22-13-26-21-11-8-18(25)12-20(21)23(22)29-14-16-4-6-17(24)7-5-16/h2-13H,14H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.25 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization