Molecule ID: mol23579

SMILES: CC(=O)NC(CSc1ccccc1)C(=O)O

InChI: InChI=1S/C11H13NO3S/c1-8(13)12-10(11(14)15)7-16-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.60 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization