Molecule ID: mol19613

SMILES: Cc1c(Cc2ccccc2S(=O)(=O)c2cccc(Cl)c2)c2c(n1CC(=O)O)CCNC2=O

InChI: InChI=1S/C23H21ClN2O5S/c1-14-18(22-19(9-10-25-23(22)29)26(14)13-21(27)28)11-15-5-2-3-8-20(15)32(30,31)17-7-4-6-16(24)12-17/h2-8,12H,9-11,13H2,1H3,(H,25,29)(H,27,28)

Experimental Macro pKa Values

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