COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK924400
Chemical Name: (2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl4-bromobenzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc(cc1)Br

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Molecular Weight: 479.28
Empirical Formula: C24H15BrO6

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.818
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 78
Number of rings: 4

     

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