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ACD/Labs calculators, Symyx Draw integrated
November 2007
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TORONTO—Symyx Technologies Inc. and Advanced Chemistry Development (ACD/Labs) announced the availability of no-charge add-ins to Symyx Draw (previously MDL Draw). The add-ins calculate physical properties, generate IUPAC nomenclature and predict NMR chemical shifts. The Symyx Draw calculator add-ins enable researchers to calculate molecular properties such as pKa, logD, logP and solubility, generate IUPAC names and predict 13C NMR and 1H NMR chemical shifts and coupling constants, as well as 2D NMR spectra without leaving the Isentris environment, resulting in smoother workflows and increased productivity. Bioconcentration factor, adsorption coefficient and boiling point calculators round out the suite of available tools 

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