Molecule ID: mol20366

SMILES: CC1(C)CCc2cc(S(=O)(=O)N(CC(=O)O)Cc3cccc(-c4ccccc4)c3)ccc2O1

InChI: InChI=1S/C26H27NO5S/c1-26(2)14-13-22-16-23(11-12-24(22)32-26)33(30,31)27(18-25(28)29)17-19-7-6-10-21(15-19)20-8-4-3-5-9-20/h3-12,15-16H,13-14,17-18H2,1-2H3,(H,28,29)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.40 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization