Molecule ID: mol27565

SMILES: O=C(O)CSC(=S)NCc1ccccc1

InChI: InChI=1S/C10H11NO2S2/c12-9(13)7-15-10(14)11-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.99 AttenGpKa training set -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization