Molecule ID: mol18420

SMILES: COc1ccc(-n2cc(/C=N/O)[n+](C)c2)cc1

InChI: InChI=1S/C12H13N3O2/c1-14-9-15(8-11(14)7-13-16)10-3-5-12(17-2)6-4-10/h3-9H,1-2H3/p+1/b13-7+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization