Molecule ID: mol36610

SMILES: COC(=O)NS(=O)(=O)Oc1ccc(C#N)cc1

InChI: InChI=1S/C9H8N2O5S/c1-15-9(12)11-17(13,14)16-8-4-2-7(6-10)3-5-8/h2-5H,1H3,(H,11,12)

Experimental Macro pKa Values

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