Molecule ID: mol17979

SMILES: COc1cc(C(F)(F)F)ccc1-c1cccc2cc(S(=O)(=O)Nc3nccs3)ccc12

InChI: InChI=1S/C21H15F3N2O3S2/c1-29-19-12-14(21(22,23)24)5-7-18(19)17-4-2-3-13-11-15(6-8-16(13)17)31(27,28)26-20-25-9-10-30-20/h2-12H,1H3,(H,25,26)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization