COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049335
Chemical Name: (4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethoxy-3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1

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Molecular Weight: 501.54
Empirical Formula: C29H27NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.913
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 94
Number of rings: 5

     

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