Submission Details
Molecule(s):
C=C(Cc1ccno1)C(=O)N1CCN(Cc2cccc(C#N)c2)CC1
Design Rationale:
Fragment linking, trying to reach water/DMSO pocket to accept H-bond from histidine Terminal alkene as part of michael acceptor reactive to cysteine Chloro -> nitrile switch
Other Notes:
SMcK-011