COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177107
Chemical Name: (5E)-2-amino-5-(3-bromo-4-methoxybenzylidene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Smiles: N#CC1=C(C)/C(=C\c2ccc(c(c2)Br)OC)/c2c1nc(N)c(c2C)C#N

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Molecular Weight: 407.27
Empirical Formula: C20H15BrN4O

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 6.091
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 95
Number of rings: 3

     

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