Molecule ID: mol21501

SMILES: Cn1cc[n+](COCc2ccc(F)cc2)c1/C=N/O

InChI: InChI=1S/C13H14FN3O2/c1-16-6-7-17(13(16)8-15-18)10-19-9-11-2-4-12(14)5-3-11/h2-8H,9-10H2,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization