RECAP -

Retrosynthetic Combinatorial Analysis Procedure:

A Powerful New Technique for Identifying Privileged Molecular Fragments.


Xiao Qing Lewell , Duncan Judd, Steve Watson, Mike Hann

GlaxoWellcome, Stevenage, UK. E-mail: xql4406@ggr.co.uk


Abstract

Presentation slides:

Introduction

Successful Modern Pharmaceutical Company

Combinatorial Library Construction

Motif-based Library Design

Contrasting Techniques for Identifying Motifs

RECAP Illustration

Bond Cleavage Rules

An Example of Cleavage

RECAP Technical Details

Applications

Fragmenting WDI Molecules
Relate Fragment to Therapeutic Activity
  • Sympatholytics Fragment
  • Antibiotics Fragment
  • Leukotriene Fragment
  • Leukotriene Antagonist Structures
  • Library Monomer Design
    Appropriate Monomer Mass
    Indole as Potential Monomer for Amide Chemistry
    Design or Select Monomer

    WDI Fragment Knowledge Base

    Summary

    Acknowledgement