COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052788
Chemical Name: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(3-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccc(c(c1)OCC)O

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Molecular Weight: 472.45
Empirical Formula: C23H24N2O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.843
Rotatable bonds: 12
H-donors: 3
H-acceptors: 9
PSA: 162
Number of rings: 3

     

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