Molecule ID: mol7591

SMILES: c1ccc(CNc2nnc(-c3ccccc3)o2)cc1

InChI: InChI=1S/C15H13N3O/c1-3-7-12(8-4-1)11-16-15-18-17-14(19-15)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,18)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.33 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization