COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL412281
Chemical Name: 5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzylidene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Smiles: CCOc1cc(/C=C/2\C(=O)OC(OC2=O)(C)C(C)(C)C)cc(c1OCc1ccccc1Cl)Br

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Molecular Weight: 537.83
Empirical Formula: C25H26BrClO6

Physical State: Dry powder
Available Amount: 529 mg

Lipinsky:
logP: 5.456
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 3

     

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