Molecule ID: mol34393

SMILES: COc1ccc(NC(=S)CC(C)=O)cc1

InChI: InChI=1S/C11H13NO2S/c1-8(13)7-11(15)12-9-3-5-10(14-2)6-4-9/h3-6H,7H2,1-2H3,(H,12,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.83 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization