Molecule ID: mol28107

SMILES: CN(C)C(=Nc1cnc2ccccc2c1)N(C)C

InChI: InChI=1S/C14H18N4/c1-17(2)14(18(3)4)16-12-9-11-7-5-6-8-13(11)15-10-12/h5-10H,1-4H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.32 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization