COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK618989
Chemical Name: (2Z)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylidene]-6-[(3-methylbut-2-en-1-yl)oxy]-1-benzofuran-3(2H)-one
Smiles: CC(=CCOc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O)C

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Molecular Weight: 443.29
Empirical Formula: C22H19BrO5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.619
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 53
Number of rings: 4

     

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