COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK117930
Chemical Name: 2-butyl-2-methyl-5-[4-(pyrrolidin-1-yl)benzylidene]-1,3-dioxane-4,6-dione
Smiles: CCCCC1(C)OC(=O)/C(=C/c2ccc(cc2)N2CCCC2)/C(=O)O1

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Molecular Weight: 343.42
Empirical Formula: C20H25NO4

Physical State: Dry powder
Available Amount: 212 mg

Lipinsky:
logP: 3.055
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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