Virtual reaction design for chemists

May 2010 Author: ()
Product Reactor Product group Discovery toolkit

Library enumeration is a powerful way for the generation libraries containing loads of NON-synthesizable compounds. At least not on that planned synthetic route due to activation/deactivation issues, directing rules and side reactions. The design of virtual reactions will be demonstrated via step-by-step examples: sketching generic reaction scheme, examination of the foreseeable synthetic problems, finding out and formulating solutions to get reusable reactions producing synthetically feasible compounds.