ChemistryAtlas Dataset

ClinTox

ADMET and toxicityclinical toxicitydrug safetyMoleculeNet
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Benchmark for predicting clinical trial toxicity and FDA approval-related toxicity signals.

Category: ADMET and toxicity.

Citation: Wu et al., Chem Sci 2018.

TypeDataset
DomainADMET and toxicity
LicensePublic research dataset
ContributorsMoleculeNet