Submission Details

BEN-DND-4f474d93
Molecule(s):
O=C(Nc1cncc2cnccc12)[C@@H]1CCOc2ccc(Cl)cc21

BEN-DND-4f474d93-1

O=C(Nc1cncc2cnccc12)[C@@H]1CCOc2ccc(Cl)cc21

3-aminopyridine-like Assayed Check Availability on Manifold View
O=C(Nc1cncc2ccncc12)[C@@H]1CCOc2ccc(Cl)cc21

BEN-DND-4f474d93-2

O=C(Nc1cncc2ccncc12)[C@@H]1CCOc2ccc(Cl)cc21

3-aminopyridine-like Assayed Check Availability on Manifold View
O=C(Nc1cncc2cnccc12)C1CCOc2ccc(Cl)cc21

BEN-DND-4f474d93-3

O=C(Nc1cncc2cnccc12)C1CCOc2ccc(Cl)cc21

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

lowering of LogD by introduction of additional N; previous SAR suggests may take slight (5 fold) hit on potency, but probably worth it given the logD gains (approx 1.3 unit LogD gain based on Calc LogD)

Inspired By:
Discussion:

Contributor: Benjamin Perry, DNDi - Thu, 05 Nov 2020 15:46:37 +0000