PharmPK Discussion - Free Online ADME Prediction Tools

• On 10 Aug 2007 at 17:48:50, "M Jamei" (masoud.jamei.aaa.gmail.com) sent the message
  

  
  Dear All
  
  Mechanistic algorithms for PK are becoming more popular amongst PKPD
  modellers; however in many cases measured values of some fundamental
  parameter are not available. The Simcyp Population-Based ADME
  Simulator contains a Prediction Toolbox, which allows a user to
  quickly estimate a number of different ADME-related parameters.
  This set of tools has proved popular amongst the modellers within
  Simcyp Consortium Members organisations and so we are pleased to
  announce that we have decided to make it freely available on-line at
  the following website http://www.simcyp.com/ProductServices/
  FreeADMETools/.
  Currently, using these tools you can predict the following
  parameters: fu (the fraction of drug unbound in plasma) for an
  average person using two different approaches; fu mic (the fraction
  of drug unbound in a microsomal incubation); QGut (a nominal drug-
  dependent flow term used in the prediction of 'first-pass' drug
  metabolism in the gut wall); and assess the likely impact of atypical
  kinetics.
  More tools will be added in the future pending on feedback received.
  
  Regards
  Masoud
  
  

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