COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053207
Chemical Name: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(3-nitrophenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)[N+](=O)[O-])/O)/C1c1ccc(cc1)C

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Molecular Weight: 426.43
Empirical Formula: C22H22N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.804
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 132
Number of rings: 3

     

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