Molecule ID: mol13019

SMILES: S=CNc1ccccc1Cl

InChI: InChI=1S/C7H6ClNS/c8-6-3-1-2-4-7(6)9-5-10/h1-5H,(H,9,10)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.03 QSARToolbox 0 » -1
10.03 Datawarrior 0 » -1
10.03 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization