Submission Details

WJF-WAB-5e8b96ca
Molecule(s):
CC(=O)NCCC1CNc2c(CC(=O)Nc3ccccc3C)cccc21

WJF-WAB-5e8b96ca-1

CC(=O)NCCC1CNc2c(CC(=O)Nc3ccccc3C)cccc21

3-aminopyridine-like Check Availability on Manifold View
Design Rationale:

Merging inhibitor design based upon Mpro-x0104 and Mpro-x0107. The distance between the two fragments was 1.340 Angstroms, which falls within the literature distance for a carbon bond. Therefore, I thought it would work to simply connect the two fragments and use it as an inhibitor.

Discussion:

Contributor: WJF, WAB - Thu, 09 Dec 2021 06:46:27 +0000