COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050289
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCc1ccccc1

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Molecular Weight: 485.54
Empirical Formula: C29H27NO6

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.481
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 85
Number of rings: 5

     

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