Molecule ID: mol31605

SMILES: CN=[N+]=Nc1ccccc1/C(C)=N/O

InChI: InChI=1S/C9H10N4O/c1-7(12-14)8-5-3-4-6-9(8)11-13-10-2/h3-6H,1-2H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization