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  • Building a Combinatorial Library: ChemDraw, ChemACX, & ChemFinder as Tools for Organic Synthesis
    • Building a Combinatorial Library: ChemDraw, ChemACX, & ChemFinder as Tools for Organic Synthesis

    • Presenter: Jesse Gordon , Company: PerkinElmer Informatics
    • Duration: 51 min
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  • In this webinar, we will demonstrate techniques for building a library of sesquiterpenes as an example of a combinatorial library. We’ll demonstrate enumeration of both commercially-available and never-made-before compounds, for analysis in ChemDraw/Excel and ChemFinder.

    The specifics include:

    • Build a compound library from ChemACX, for available substances.
    • Build a combinatorial library from ChemDraw’s Generic Structure, for never-made-before structures.
    • Include the following categories for Markush enumeration and chemical search: Acyclics, Monocyclics, Bicyclics, Cyclic Alcohols, & Cadinenes.
    • For each category, create an SDFile from ChemDraw and ACX.
    • Merge them all into both ChemFinder and CD/Excel
    • Show search, sort, export, and R-Group analysis in both
    • Compare CombiChem/Excel with all of the above.

    Please watch this informative webinar.



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      • Finding a combinatorial library in ACX by list of CAS numbers. FLASH Format
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