Molecule ID: mol15540

SMILES: Nc1ccc(-c2ncc(-c3ccc(Cl)cc3)o2)cc1

InChI: InChI=1S/C15H11ClN2O/c16-12-5-1-10(2-6-12)14-9-18-15(19-14)11-3-7-13(17)8-4-11/h1-9H,17H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.10 Datawarrior 2 » 1
2.87 QSARToolbox 1 » 0
2.87 OCHEM 1 » 0
2.87 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization