Molecule ID: mol3896

SMILES: NCc1cccs1

InChI: InChI=1S/C5H7NS/c6-4-5-2-1-3-7-5/h1-3H,4,6H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.92 IUPAC digitized pKa 1 » 0
8.92 OCHEM 1 » 0
8.92 AttenGpKa training set 1 » 0
8.92 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization