Submission Details

HAR-NEW-ca1d46ce
Molecule(s):
C=CC(=O)COc1cccc(NC(=O)Nc2cnccc2CC2CCNC(=O)N2)c1

HAR-NEW-ca1d46ce-1

C=CC(=O)COc1cccc(NC(=O)Nc2cnccc2CC2CCNC(=O)N2)c1

3-aminopyridine-like Check Availability on Manifold View
O=C(Nc1cccc(O)c1)Nc1cnccc1CC1CCNC(=O)N1

HAR-NEW-ca1d46ce-2

O=C(Nc1cccc(O)c1)Nc1cnccc1CC1CCNC(=O)N1

3-aminopyridine-like Check Availability on Manifold View
Design Rationale:

Visual inspection of 0434, 0540, 0678 to give non-covalent molecule (included); docking of structure and visual inspection to determine best site to place covalent warhead

Inspired By:
Discussion:

Contributor: Harriet Stanway-Gordon, Newcastle University - Fri, 03 Apr 2020 00:05:42 +0000