Molecule ID: mol21145

SMILES: N[C@@H]1C[C@]1(F)c1ccc(Cl)cc1

InChI: InChI=1S/C9H9ClFN/c10-7-3-1-6(2-4-7)9(11)5-8(9)12/h1-4,8H,5,12H2/t8-,9+/m1/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization