Submission Details

PET-UNK-dd44aeb6
Molecule(s):
O=C(Cc1cc(Cl)ccc1F)Nc1cncc2ccccc12

PET-UNK-dd44aeb6-1

O=C(Cc1cc(Cl)ccc1F)Nc1cncc2ccccc12

3-aminopyridine-like Assayed Check Availability on Manifold View
O=C(Cc1cc(Cl)ccc1Cl)Nc1cncc2ccccc12

PET-UNK-dd44aeb6-2

O=C(Cc1cc(Cl)ccc1Cl)Nc1cncc2ccccc12

3-aminopyridine-like Assayed Check Availability on Manifold View
N#Cc1ccc(Cl)cc1CC(=O)Nc1cncc2ccccc12

PET-UNK-dd44aeb6-3

N#Cc1ccc(Cl)cc1CC(=O)Nc1cncc2ccccc12

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

These designs introduce structural modifications intended to counter metabolism of the P2 aromatic ring and they may also protect the benzylic carbon.

Other Notes:

I believe that it it would be useful to have enzyme inhibition IC50 values readily available should metabolism of the P2 aromatic ring become an issue.

Inspired By:
Discussion:

Contributor: Peter Kenny - Thu, 24 Sep 2020 17:50:39 +0000