Submission Details

JRB-FNM-036b040c

Molecule(s):

CC(=O)C1=CC2=C(CNC3CC(O)CC(CC4N=Cc5ccccc54)C3)C(CC3C=Nc4ccc(C(N)=O)cc43)=CC2C(CSO)=C1

JRB-FNM-036b040c-1

CC(=O)C1=CC2=C(CNC3CC(O)CC(CC4N=Cc5ccccc54)C3)C(CC3C=Nc4ccc(C(N)=O)cc43)=CC2C(CSO)=C1

Check Availability on Manifold View

Design Rationale:

Used Autodock Vina to dock and find binding energy.

Discussion:

Contributor: JRB, FNM - Tue, 06 Oct 2020 18:32:53 +0000