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ASAP Discovery x OpenADMET CompetitionTake part in the first prospective benchmark on Polaris.

Dataset

tdcommons/half-life-obach

Half life duration.

Created on: July 22, 2024Dataset size: 29 KBNumber of datapoints: 667
Public

Status

Uncertified

This artifact has not been certified by approved reviewers. It may contain issues related to data quality.

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Tags

ADME

Modalities

MOLECULE

Details

README

Background

Half life of a drug is the duration for the concentration of the drug in the body to be reduced by half. It measures the duration of actions of a drug. This dataset is from [1] and we obtain the deposited version under CHEMBL assay 1614674.

Description of readout

Task Description: Regression. Given a drug SMILES string, predict the half life duration.

Data resource

References: [1] Trend Analysis of a Database of Intravenous Pharmacokinetic Parameters in Humans for 670 Drug Compounds