COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK992824
Chemical Name: (2Z)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylidene]-6-[(4-methylbenzyl)oxy]-1-benzofuran-3(2H)-one
Smiles: Cc1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O

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Molecular Weight: 479.33
Empirical Formula: C25H19BrO5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.854
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 53
Number of rings: 5

     

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