Molecule ID: mol18949

SMILES: Cn1cc[n+](CCCC[n+]2ccn(C)c2/C=N/O)c1/C=N/O

InChI: InChI=1S/C14H20N6O2/c1-17-7-9-19(13(17)11-15-21)5-3-4-6-20-10-8-18(2)14(20)12-16-22/h7-12H,3-6H2,1-2H3/p+2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.02 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization