Molecule ID: mol13744

SMILES: CC1=Nc2ccccc2N=C(C)C1

InChI: InChI=1S/C11H12N2/c1-8-7-9(2)13-11-6-4-3-5-10(11)12-8/h3-6H,7H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization