COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL412272
Chemical Name: 5-(3-bromo-4-methoxybenzylidene)-2-butyl-2-methyl-1,3-dioxane-4,6-dione
Smiles: CCCCC1(C)OC(=O)/C(=C/c2ccc(c(c2)Br)OC)/C(=O)O1

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Molecular Weight: 383.24
Empirical Formula: C17H19BrO5

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 3.038
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 61
Number of rings: 2

     

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