COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039889
Chemical Name: (4E)-1-butyl-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 414.85
Empirical Formula: C21H19ClN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.905
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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