Molecule ID: mol35544

SMILES: Nc1cccc(-c2cccc(Cl)n2)n1

InChI: InChI=1S/C10H8ClN3/c11-9-5-1-3-7(13-9)8-4-2-6-10(12)14-8/h1-6H,(H2,12,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization