Glide Fragment Library

Set of 441 unique small fragments (1-7 ionization/tautomer variants; 6-37 atoms; MW range 32-226) derived from molecules in the medicinal chemistry literature. The set includes a total of 667 fragments with accessible low energy ionization and tautomeric states and metal and state penalties for each compound from Epik. These can be used for fragment docking, core hopping, lead optimization, de novo design, etc.

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Last Updated: 06/28/2009