Molecule ID: mol20992

SMILES: N#C/C(=N\O)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

InChI: InChI=1S/C11H5F6N3O2/c12-10(13,14)5-1-6(11(15,16)17)3-7(2-5)19-9(21)8(4-18)20-22/h1-3,22H,(H,19,21)/b20-8+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization