COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112563
Chemical Name: (5Z)-2-amino-5-(2-bromo-4-ethoxy-5-methoxybenzylidene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Smiles: CCOc1cc(Br)c(cc1OC)/C=C\1/C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C

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Molecular Weight: 451.32
Empirical Formula: C22H19BrN4O2

Physical State: Dry powder
Available Amount: 164 mg

Lipinsky:
logP: 7.023
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 104
Number of rings: 3

     

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