Molecule ID: mol21000

SMILES: COc1ccc(NC(=O)/C(C#N)=N/O)cc1

InChI: InChI=1S/C10H9N3O3/c1-16-8-4-2-7(3-5-8)12-10(14)9(6-11)13-15/h2-5,15H,1H3,(H,12,14)/b13-9+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.08 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization