ChemDiv’s Beyond the Flatland Library contains 93,483 compounds.
“Escape from Flatland” – New Approach for Scaffold & Library Design. Fsp3 = number of sp3-hybridized carbons/ total carbon count.
The increase of scaffold/molecule saturation leads to:
More diverse set of compounds
More highly complex molecules
Access to greater chemical space
Better complement to the spatial subtleties of target proteins
3D-dimensionality may result in greater selectivity
Higher water solubility
Better phys-chemical parameters (logP and PSA)
Very low increase of MW
As result: Faster transition of compound from discovery to drugs.
Medicinal and Computational Chemistry Dept., ChemDiv, Inc.
12760 High Bluff Dr, San Diego, CA, 92130
Phone: + 1 916 234 0888
Fax: +1 858 794 4931
You can buy this library or customize your own library from our discovery collection of 1 600 000 compounds and 60 000 building blocks.