Submission Details

DAR-DIA-4987d2cd
Molecule(s):
Nc1c(N2Cc3ccc(Cl)cc3C(C(=O)Nc3cncc4ccccc34)C2)c(=O)c1=O

DAR-DIA-4987d2cd-1

Nc1c(N2Cc3ccc(Cl)cc3C(C(=O)Nc3cncc4ccccc34)C2)c(=O)c1=O

3-aminopyridine-like Check Availability on Manifold View
O=C(Nc1cncc2ccccc12)C1CN(c2c(O)c(=O)c2=O)Cc2ccc(Cl)cc21

DAR-DIA-4987d2cd-2

O=C(Nc1cncc2ccccc12)C1CN(c2c(O)c(=O)c2=O)Cc2ccc(Cl)cc21

3-aminopyridine-like Check Availability on Manifold View
Nc1c(N2Cc3ccc(Cl)cc3C2C(=O)Nc2cncc3ccccc23)c(=O)c1=O

DAR-DIA-4987d2cd-3

Nc1c(N2Cc3ccc(Cl)cc3C2C(=O)Nc2cncc3ccccc23)c(=O)c1=O

3-aminopyridine-like Check Availability on Manifold View
O=C(Nc1cncc2ccccc12)C1c2cc(Cl)ccc2CN1c1c(O)c(=O)c1=O

DAR-DIA-4987d2cd-4

O=C(Nc1cncc2ccccc12)C1c2cc(Cl)ccc2CN1c1c(O)c(=O)c1=O

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

Squaramide substitution of sulfonamide from MAT-POS-dd3ad2b5-4 to branch between Asn142 and Gln189 plus 5 membered analogues.

Inspired By:
Discussion:

Contributor: Daren Fearon, Diamond Light Source Ltd - Mon, 22 Mar 2021 21:04:04 +0000