Breaching Seven Trillion Compounds: 2nd Version of the eXplore Chemical Space

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Breaching Seven Trillion Compounds: 2nd Version of the eXplore Chemical Space

December 9, 2022 13:49 CET

One trillion compounds for each of the seven dwarfs — We are proud to announce the second version of the vast eXplore Chemical Space by eMolecules!
The second iteration comes with 7,030,188,488,107 virtual compounds resulting from 49 chemical reactions. Again, high emphasis was put on the accessibility of compounds to make the molecule collection actionable for institutes around the world: The molecules can easily be synthesized in one to two steps or you can approach eMolecules if you want your compounds to be synthesized by a third party.

The novel reactions have been added to the eXplore cookbook. Download it and check out what can possibly be achieved with the largest make-on-demand Chemical Space.
eXplore can be screened with BioSolveIT’s Chemical Space navigation platform infiniSee.