COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153068
Chemical Name: 2-({5-bromo-2-methoxy-4-[(E)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Smiles: COc1cc(/C=C\2/SC(=O)N(C2=O)C)c(cc1OCc1ccccc1C#N)Br

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Molecular Weight: 459.32
Empirical Formula: C20H15BrN2O4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 4.471
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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