COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051634
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxyphenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)OCC

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Molecular Weight: 453.49
Empirical Formula: C25H27NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.486
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 94
Number of rings: 4

     

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