COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110891
Chemical Name: 2-{[(5E)-5-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl}benzonitrile
Smiles: CCOc1cc(/C=C\2/SC(=O)N(C2=O)Cc2ccccc2C#N)cc(c1O)Br

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Molecular Weight: 459.32
Empirical Formula: C20H15BrN2O4S

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 4.597
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 115
Number of rings: 3

     

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