Molecule ID: mol18919

SMILES: COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(OC)c(NS(C)(=O)=O)n2)c(OC)c1

InChI: InChI=1S/C19H24N2O8S2/c1-26-14-10-17(28-3)15(18(11-14)29-4)8-9-31(24,25)12-13-6-7-16(27-2)19(20-13)21-30(5,22)23/h6-11H,12H2,1-5H3,(H,20,21)/b9-8+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization