Molecule ID: mol7133

SMILES: CN=c1ncccn1Cc1ccccc1

InChI: InChI=1S/C12H13N3/c1-13-12-14-8-5-9-15(12)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization