COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048063
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: CCOc1cccc(c1)C1N(CCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

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Molecular Weight: 485.54
Empirical Formula: C29H27NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.481
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 85
Number of rings: 5

     

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