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scikit-fingerprints/Biogen_ADME_Solubility

Biogen ADME Solubility Biogen_ADME_Solubility dataset from the Biogen ADME benchmark [1]. It is intended to be used through scikit-fingerprints library. The task is to predict log10 of aqueous solubility at pH 6.8 (in ug/mL) of molecules. Characteristic Description Tasks 1 Task type regression Total samples 2173 Recommended split time Recommended metric MAE References [1] Fang, Cheng, et al. "Prospective Validation of Machine Learning… See the full description on the dataset page: https://huggingface.co/datasets/scikit-fingerprints/Biogen_ADME_Solubility.

Author / organizationscikit-fingerprints
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Created4 April 2026
Last updated at source4 April 2026
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  • 17 Oct 2026 Description: Biogen ADME Solubility Biogen_ADME_Solubility dataset from the Biogen ADME benchmark [1]. It is intended to be used through scikit-fingerprints library. The task is to predict log10 of aqueous solubility at pH 6.8 (in ug/mL) of molecules. C → Biogen ADME Solubility Biogen_ADME_Solubility dataset from the Biogen ADME benchmark [1]. It is intended to be used through scikit-fingerprints library. The task is to predict log10 of aqueous solubility at pH 6.8 (in ug/mL) of molecules. C

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