COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585855
Chemical Name: ethyl4-[(3E)-3-[hydroxy(phenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccccc2)\O)/C(=O)C1=O

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Molecular Weight: 472.45
Empirical Formula: C26H20N2O7

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 5.048
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 129
Number of rings: 4

     

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