COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396947
Chemical Name: (5E)-2-amino-5-{3-bromo-4-[(2-cyanobenzyl)oxy]benzylidene}-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Smiles: N#CC1=C(C)/C(=C\c2ccc(c(c2)Br)OCc2ccccc2C#N)/c2c1nc(N)c(c2C)C#N

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Molecular Weight: 508.38
Empirical Formula: C27H18BrN5O

Physical State: Dry powder
Available Amount: 356 mg

Lipinsky:
logP: 7.183
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 119
Number of rings: 4

     

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