Molecule ID: mol30681

SMILES: C[n+]1ccc(/N=N/c2ccc(O)cc2)cc1

InChI: InChI=1S/C12H11N3O/c1-15-8-6-11(7-9-15)14-13-10-2-4-12(16)5-3-10/h2-9H,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization