No matter how big your in-house library and no matter how many compounds you acquire to add to it, it will only be a tiny fraction of what your chemists are capable of synthesizing.
120 MedChem reactions including
For example: Benzoxazole formation
For example: Hydantoin formation
For example: hetero-aromatic substitution
For example: C-C coupling
For a detailed list of all reactions see the
Aiming at new scaffolds, no PAINS and reasonable solubility we collected reactions from the literature, namely:
Plus reagents from "trusted vendors" based on the eMolecules collection.
...is a literature-based virtual chemistry space covering hundreds of billions of virtual products with high likelihood of synthetic accessibility. An overview of the data can be found here. This space is ready for searching but can also serve as a blueprint for customization capitalizing on your proprietary building blocks and chemistry protocols.