COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK628028
Chemical Name: (2Z)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylidene]-6-{[(2E)-3-phenylprop-2-en-1-yl]oxy}-1-benzofuran-3(2H)-one
Smiles: Brc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC/C=C/c2ccccc2)c2c(c1)COCO2

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Molecular Weight: 491.34
Empirical Formula: C26H19BrO5

Physical State: Dry powder
Available Amount: 384 mg

Lipinsky:
logP: 6.035
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 53
Number of rings: 5

     

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