Molecule ID: mol3524

SMILES: N#Cc1cc(N)cc2ccccc12

InChI: InChI=1S/C11H8N2/c12-7-9-6-10(13)5-8-3-1-2-4-11(8)9/h1-6H,13H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization