Molecule ID: mol12688

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

InChI: InChI=1S/C9H11NOS/c1-7(12)10-8-3-5-9(11-2)6-4-8/h3-6H,1-2H3,(H,10,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.96 Datawarrior 0 » -1
11.96 OCHEM 0 » -1
11.96 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization