Molecule ID: mol24979

SMILES: O=[N+]([O-])c1ccc(C(/N=N/c2ccccc2)=N\Nc2ccccc2)cc1

InChI: InChI=1S/C19H15N5O2/c25-24(26)18-13-11-15(12-14-18)19(22-20-16-7-3-1-4-8-16)23-21-17-9-5-2-6-10-17/h1-14,20H/b22-19+,23-21+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization