five

Lead-like (compounds 1, 2, 4, 6, 8, 10, 14, 15) and drug-like (compounds 3, 5, 7, 9, 11, 12, 13) molecules selected by the VS.

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Figshare2015-12-02 更新2026-04-29 收录
下载链接:
https://figshare.com/articles/dataset/_Lead_like_compounds_1_2_4_6_8_10_14_15_and_drug_like_compounds_3_5_7_9_11_12_13_molecules_selected_by_the_VS_/347278
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The table summarizes, for each compound, the ZINC-code, the Ambinter-code, the molecular weight, the number of matched features of the final PH, the experimental Ki and/or Ki′ values, the BE, and the inhibition profile. n.d., not determined.
创建时间:
2015-12-02
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