Molecule ID: mol7234

SMILES: Cn1cc(-c2ccc(Cl)cc2)cnc1=N

InChI: InChI=1S/C11H10ClN3/c1-15-7-9(6-14-11(15)13)8-2-4-10(12)5-3-8/h2-7,13H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization