Molecule ID: mol1644

SMILES: Nc1ccc(Cc2ccccc2)cc1

InChI: InChI=1S/C13H13N/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10,14H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.78 IUPAC digitized pKa 1 » 0
4.78 OCHEM 1 » 0
4.78 Hunt 1 » 0
4.78 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization