Molecule ID: mol13161

SMILES: Cn1cc2ccccc2n1

InChI: InChI=1S/C8H8N2/c1-10-6-7-4-2-3-5-8(7)9-10/h2-6H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.01 AttenGpKa training set 1 » 0
2.13 Datawarrior 1 » 0
2.13 OCHEM 1 » 0
2.13 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization