COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543911
Chemical Name: (4E)-1-(4-bromophenyl)-4-[ethoxy(hydroxy)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCO/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)Br)/O

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Molecular Weight: 447.24
Empirical Formula: C19H15BrN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.897
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 112
Number of rings: 3

     

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