Molecule ID: mol37013

SMILES: COc1ccc(C(=O)N[S+](C)C)cc1

InChI: InChI=1S/C10H13NO2S/c1-13-9-6-4-8(5-7-9)10(12)11-14(2)3/h4-7H,1-3H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization