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Bemis-Murcko Frameworks, Loose Algorithm

Bemis-Murcko Framework with loose algorithm is calculated by removing side chains from the input structure. Exocyclic non-single bonded atoms are kept. Remaining bond types are not changed. We analyzed commercially available compounds and calculated Bemis-Murcko Frameworks.

Bemis-Murcko Loose Framework reduction example

Most Frequently Found Frameworks of Building Blocks

Top building block frameworks were calculated from commercially available building blocks listed in the MolPort database. The 3000 most frequently found frameworks are listed below. They are sorted by heavy atom count from smallest to largest and by molecular weight (smallest to largest).

2021 MolPort, v5.63, release date 17-01-2022 10:00 (+0200). All rights reserved.
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