Molecule ID: mol7184

SMILES: CCCCNc1nc(C)cc(C)n1

InChI: InChI=1S/C10H17N3/c1-4-5-6-11-10-12-8(2)7-9(3)13-10/h7H,4-6H2,1-3H3,(H,11,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization