Clinically Approved Small Molecule Antibiotics Since 2010 with Calculated Properties

Properties of clinically approved small molecule antibiotics approved since 2010 are summarized. The dataset includes approval year, mechanism of action, and molecular properties. It was compiled by Erik Jung of the University of Zurich, with some properties retrieved from cited references and others calculated using DataWarrior software.

Use Cases

• Analyzing trends in antibiotic approval and mechanism of action based on the 'Year approved' and 'Mechanism of action' fields.
• Modeling drug-likeness and molecular properties based on calculated descriptors like 'cLogP', 'cLogS', and 'DrugScore'.
• Studying structure-activity relationships for antibiotics using the provided 'Smiles' strings and derived properties like 'Molecular Flexibility'.

Strengths

• Focuses on a specific and recent time frame of antibiotics approved since 2010.
• Includes a mix of factual clinical properties (e.g., 'Indication', 'Administration') and calculated molecular descriptors (e.g., 'Molweight', 'Polar Surface Area').
• Properties are sourced from cited references and calculated with a specific, named software tool (DataWarrior).

Limitations

• Row count is unknown, which may limit suitability assessment for large-scale modeling.
• Column-level documentation is absent; field semantics must be inferred from the description after download.
• Last update date is unknown; freshness unverified.

Provenance

Source

University of Zurich (Erik Jung), via paperswithcode.

Collection Method

Properties were retrieved from cited references and calculated with DataWarrior software.

Time Range

Antibiotics approved since 2010.