COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041008
Chemical Name: (4E)-1-(4-acetylphenyl)-4-[hydroxy(phenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CC(=O)c1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 442.43
Empirical Formula: C25H18N2O6

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.986
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 120
Number of rings: 4

     

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