Litcius/Paper detail

Principles and Applications of CF<sub>2</sub>X Moieties as Unconventional Halogen Bond Donors in Medicinal Chemistry, Chemical Biology, and Drug Discovery

Sebastian Vaas, Markus O. Zimmermann, Dieter Schollmeyer, Jason Stahlecker, M. Engelhardt, Janosch Rheinganz, Bernhard Drotleff, Matthias Olfert, Michael Lämmerhofer, Markus Krämer, Thilo Stehle, Frank M. Boeckler

2023Journal of Medicinal Chemistry53 citationsDOIOpen Access PDF

Abstract

Br toward the P-loop, as well as chalcogen bonds. We suggest that underexplored chemical space combined with unconventional binding modes provides excellent opportunities for patentable chemotypes for therapeutic intervention.

Topics & Concepts

ChemistryChemical spaceDrug discoveryHalogen bondHalideCombinatorial chemistryComputational chemistrySolubilityArylChemical biologyChemical stabilityBinding affinitiesChalcogenHalogenMoleculeChemical shiftStereochemistryOrganic chemistryHydrogen bondPhysical chemistryReceptorAlkylBiochemistryCrystallography and molecular interactionsFluorine in Organic ChemistryStructural and Chemical Analysis of Organic and Inorganic Compounds