Molecule ID: mol31607

SMILES: CN=[N+]=Nc1cccc(/C(C)=N/O)c1

InChI: InChI=1S/C9H10N4O/c1-7(12-14)8-4-3-5-9(6-8)11-13-10-2/h3-6H,1-2H3/p+1/b12-7+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization