COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL389006
Chemical Name: 5-[3-bromo-5-methoxy-4-(2-methylpropoxy)benzylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Smiles: COc1cc(C=C2C(=O)OC(OC2=O)(C)C)cc(c1OCC(C)C)Br

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Molecular Weight: 413.27
Empirical Formula: C18H21BrO6

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 2.856
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 2

     

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