Molecule ID: SM37

SMILES: CN(C)S(=O)(=O)NC1(CCc2ccccc2)C[S+]([O-])C1

InChI: InChI=1S/C13H20N2O3S2/c1-15(2)20(17,18)14-13(10-19(16)11-13)9-8-12-6-4-3-5-7-12/h3-7,14H,8-11H2,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.33 SAMPL7 0 » -1
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Charge States and Microspecies Visualization