Submission Details

Molecule(s):
CC(=O)NCCc1coc2c(CC(=O)Nc3cccnc3)c(CC3CCC(=O)CC3)ccc12

MAD-FNM-828af174-1

CC(=O)NCCc1coc2c(CC(=O)Nc3cccnc3)c(CC3CCC(=O)CC3)ccc12

3-aminopyridine-like Check Availability on Manifold View

Design Rationale:

Autodock vina was used to determine binding affinity. Structure mainly composed of fragments from Diamond Light Source.

Discussion: