COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL415666
Chemical Name: 2-butyl-5-(3,5-dibromo-2-hydroxybenzylidene)-2-methyl-1,3-dioxane-4,6-dione
Smiles: CCCCC1(C)OC(=O)/C(=C/c2cc(Br)cc(c2O)Br)/C(=O)O1

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Molecular Weight: 448.11
Empirical Formula: C16H16Br2O5

Physical State: Dry powder
Available Amount: 597 mg

Lipinsky:
logP: 4.549
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 2

     

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