Molecule ID: mol36396

SMILES: Cc1ccnc(N=Cc2ccc(N(C)C)cc2)n1

InChI: InChI=1S/C14H16N4/c1-11-8-9-15-14(17-11)16-10-12-4-6-13(7-5-12)18(2)3/h4-10H,1-3H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.63 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization