COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047162
Chemical Name: (4Z)-4-[(4-bromophenyl)(hydroxy)methylidene]-5-(3-nitrophenyl)-1-(prop-2-en-1-yl)pyrrolidine-2,3-dione
Smiles: C=CCN1C(=O)C(=O)/C(=C(/c2ccc(cc2)Br)\O)/C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 443.25
Empirical Formula: C20H15BrN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.581
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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