What question did this study set out to answer?

To introduce SwissADME, a free and accessible web tool designed to evaluate pharmacokinetics, drug-likeness, and medicinal chemistry friendliness of small molecules.

March 3, 2017Scientific ReportsOpen Access

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

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To introduce SwissADME, a free and accessible web tool designed to evaluate pharmacokinetics, drug-likeness, and medicinal chemistry friendliness of small molecules.
Integrated fast computational models to estimate physicochemical properties, ADME behaviors, and medicinal chemistry parameters.
Incorporated specialized in-house predictive models including the BOILED-Egg, iLOGP, and the Bioavailability Radar.
Constructed a login-free, user-friendly graphical web interface supporting single or batch molecule inputs.
Enabled rapid, robust prediction of key absorption, distribution, metabolism, and excretion parameters without requiring physical chemical samples.
Facilitated intuitive visual and quantitative interpretation of drug-likeness profiles for both computational specialists and non-experts.

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Implication

Computational tool reports predictive models for pharmacokinetic profiling in small molecules, suggesting streamlined early drug discovery.

Cite This Study

Daina et al. (2017) studied this question.

synapsesocial.com/papers/69d701c255f4749d0eab30bb https://doi.org/10.1038/srep42717

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Implication

Computational tool reports predictive models for pharmacokinetic profiling in small molecules, suggesting streamlined early drug discovery.

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

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Discussion

Implication

Cite This Study

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

Key Points

Discussion

Implication

Cite This Study

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