COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL415662
Chemical Name: 5-[2-(benzyloxy)-5-bromobenzylidene]-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Smiles: CC(C1(C)OC(=O)/C(=C/c2cc(Br)ccc2OCc2ccccc2)/C(=O)O1)(C)C

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Molecular Weight: 459.34
Empirical Formula: C23H23BrO5

Physical State: Dry powder
Available Amount: 962 mg

Lipinsky:
logP: 4.848
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 61
Number of rings: 3

     

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