COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK657866
Chemical Name: (2Z)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylidene]-6-[(3-chlorobenzyl)oxy]-1-benzofuran-3(2H)-one
Smiles: Brc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2cccc(c2)Cl)c2c(c1)COCO2

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Molecular Weight: 499.74
Empirical Formula: C24H16BrClO5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.989
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 53
Number of rings: 5

     

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