Medicinal Chemistry and Drug Discovery

Dear Colleagues,

Drugs discovery typically involves either identification of active substances from traditional remedies of a natural origin or the synthesis of bioactive compounds guided by rational drug design, combinatorial chemistry, high throughput screening, fragment-based lead discovery, and other approaches.  In modern drug discovery, medicinal chemistry plays a crucial role, covering new methods for the synthesis of bioactive compounds, the identification of druggable biomolecular targets, understanding molecular basis for diseases, and the design of agents modifying biochemical processes underlying the disorder.

This Special Issue aims to highlight the recent achievements in the field of drug discovery, particularly medicinal chemistry.  The scope of this Special Issue ranges from the initial stages of drug discovery and new synthetic methodologies for the synthesis of bioactive compounds to the pharmacokinetics and pharmacodynamics of investigating new drugs, and may include original research articles and reviews on identification, validation, and the exploration of drug targets; molecular modeling and structure–activity relationships; the design, synthesis, and characterization of new chemical entities with therapeutic potential; the identification, isolation, and characterization of bioactive compounds from natural products; lead optimization; drug modifications and repurposing; and the development of assays to assess therapeutic efficacy. 

Dr. Anton V. Dolzhenko
Prof. Dr. Snezana Agatonovic-Kustrin
Guest Editors

Manuscript Submission Information

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Please visit the Instructions for Authors page before submitting a manuscript. The Article Processing Charge (APC) for publication in this open access journal is 2400 CHF (Swiss Francs). Submitted papers should be well formatted and use good English. Authors may use MDPI's English editing service prior to publication or during author revisions.

• bioorganic chemistry
• combinatorial chemistry
• drug development
• drug repurposing
• drug targets
• fragment-based drug discovery
• high throughput screening
• medicinal chemistry
• molecular diversity
• natural products
• pharmaceutical analysis
• QSAR
• rational drug design
• structure–activity relationship