Molecule ID: mol7760

SMILES: Sc1cccc2ccc(-c3ccccc3)nc12

InChI: InChI=1S/C15H11NS/c17-14-8-4-7-12-9-10-13(16-15(12)14)11-5-2-1-3-6-11/h1-10,17H

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization