Molecule ID: mol7843

SMILES: CC(C)(C)c1ncnc2ccccc12

InChI: InChI=1S/C12H14N2/c1-12(2,3)11-9-6-4-5-7-10(9)13-8-14-11/h4-8H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization