Submission Details

NIR-THE-99f25457
Molecule(s):
NC(=O)C1CCC(CC(NC(=O)CCl)c2cccc3ccccc23)C1c1ccsc1

NIR-THE-99f25457-1

NC(=O)C1CCC(CC(NC(=O)CCl)c2cccc3ccccc23)C1c1ccsc1

NC(=O)C1CC2(CCCN(C(=O)CCl)C2)CC1c1ccsc1

NIR-THE-99f25457-2

NC(=O)C1CC2(CCCN(C(=O)CCl)C2)CC1c1ccsc1

NC(=O)C1CCCC1c1ccccc1CNC(=O)CCl

NIR-THE-99f25457-3

NC(=O)C1CCCC1c1ccccc1CNC(=O)CCl

NC(=O)C1CC(c2ccnc(Cl)c2NC(=O)CCl)CC1c1ccsc1

NIR-THE-99f25457-4

NC(=O)C1CC(c2ccnc(Cl)c2NC(=O)CCl)CC1c1ccsc1

Design Rationale:

These are all based on covalent fragments able to "reach" x0874. Namely: x0820, x0759, x0748, x1478

Inspired By:
Discussion:

Contributor: Nir London, The Weizmann Institute of Science - Tue, 24 Mar 2020 21:03:53 +0000