COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL415699
Chemical Name: 5-[4-(benzyloxy)-3-bromobenzylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione
Smiles: CCCCC1(C)OC(=O)/C(=C/c2ccc(c(c2)Br)OCc2ccccc2)/C(=O)O1

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Molecular Weight: 459.34
Empirical Formula: C23H23BrO5

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 4.694
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 61
Number of rings: 3

     

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