Molecule ID: mol25642

SMILES: Cn1c(-c2ccccc2)c(-c2ccccc2)[n+](O)c1-c1ccccc1

InChI: InChI=1S/C22H19N2O/c1-23-20(17-11-5-2-6-12-17)21(18-13-7-3-8-14-18)24(25)22(23)19-15-9-4-10-16-19/h2-16,25H,1H3/q+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization