COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393532
Chemical Name: 5-[3-bromo-4-(dimethylamino)benzylidene]-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Smiles: O=C1OC(C)(OC(=O)/C/1=C\c1ccc(c(c1)Br)N(C)C)C(C)(C)C

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Molecular Weight: 396.28
Empirical Formula: C18H22BrNO4

Physical State: Dry powder
Available Amount: 28 mg

Lipinsky:
logP: 3.794
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 2

     

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