Molecule ID: mol38355

SMILES: CC1(C)CN=C(Nc2cccnc2)N1

InChI: InChI=1S/C10H14N4/c1-10(2)7-12-9(14-10)13-8-4-3-5-11-6-8/h3-6H,7H2,1-2H3,(H2,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization