Submission Details

CON-WAB-e9a28e0b
Molecule(s):
O=C1CCN(CC2C=C3CCCC(CC(=O)NC4CCCNC4)C3C2)CC1

CON-WAB-e9a28e0b-1

O=C1CCN(CC2C=C3CCCC(CC(=O)NC4CCCNC4)C3C2)CC1

O=C1CCN(Cc2ccc3c(c2)C(CC(=O)NC2CCCNC2)CCC3)CC1

CON-WAB-e9a28e0b-2

O=C1CCN(Cc2ccc3c(c2)C(CC(=O)NC2CCCNC2)CCC3)CC1

Design Rationale:

This conformation seems like it fits the active site really well. These are slightly different molecules based on the same fragments.

Inspired By:
Discussion:

Contributor: Connor Rotterman, Wabash College - Tue, 07 Apr 2020 17:17:50 +0000