Molecule ID: mol16533

SMILES: CCCCCCCCCCOC[n+]1cccc(/C=N/O)c1

InChI: InChI=1S/C17H28N2O2/c1-2-3-4-5-6-7-8-9-13-21-16-19-12-10-11-17(15-19)14-18-20/h10-12,14-15H,2-9,13,16H2,1H3/p+1/b18-14+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization