Submission Details

STU-CHA-6d5cfe2b
Molecule(s):
O=C(CCl)N1CCN(Cc2cc(Cl)ccc2CNS(=O)(=O)N2CCOCC2)CC1

STU-CHA-6d5cfe2b-1

O=C(CCl)N1CCN(Cc2cc(Cl)ccc2CNS(=O)(=O)N2CCOCC2)CC1

piperazine-chloroacetamide Ordered Check Availability on Manifold View
Design Rationale:

Combination of covalent fragment x0770 with non-covalent x1249 and x0195. Sulfonyl urea analogue not docked, but parent urea scores highly (STU-CHA-6ca)

Inspired By:
Discussion:

Contributor: Stuart Ward, Charles River Laboratories - Thu, 02 Apr 2020 15:41:12 +0000