Submission Details

EDJ-MED-78f964c8
Molecule(s):
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccccc2)CC1

EDJ-MED-78f964c8-1
Duplicate of:
MAT-POS-916a2c5a-4

O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccccc2)CC1

Duplicate quinolones Assayed Check Availability on Manifold View
Design Rationale:

Piperazine analogue of MAT-POS-916a2c5a-2 designed from crystal structure as there appears to be enough space to make the extra ring and the extra buried alkyl linkers should improve potency. Both 6 and 7 membered rings generated to allow conformational flexibility. Ortho OMe removed to allow distal ring to be in plane with piperazine / homopiperazine ring N.

Inspired By:
Discussion:

Contributor: Ed J Griffen, MedChemica Ltd - Tue, 19 May 2020 20:48:38 +0000