COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568580
Chemical Name: ethyl4-{(3E)-2-(4-bromophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(cc1)Br

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Molecular Weight: 551.35
Empirical Formula: C26H19BrN2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.868
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 129
Number of rings: 4

     

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