Submission Details

GAB-FRA-261eb2a6
Molecule(s):
CN1CCN(C(=O)Cc2c[nH]c3ncccc23)[C@H](CCCNS(C)(=O)=O)C1

GAB-FRA-261eb2a6-1

CN1CCN(C(=O)Cc2c[nH]c3ncccc23)[C@H](CCCNS(C)(=O)=O)C1

Design Rationale:

Combining Mpro-x0072 and Mpro-x1093. Gives a reasonable binding energy in AutoDock Vina.

Discussion:

Contributor: Gabriel Brandt, Franklin & Marshall College - Tue, 06 Oct 2020 04:25:46 +0000