COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393460
Chemical Name: 5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Smiles: COc1cc(ccc1OCc1ccc(cc1)Cl)C=C1C(=O)OC(OC1=O)(C)C

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Molecular Weight: 402.83
Empirical Formula: C21H19ClO6

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.944
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 3

     

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