COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563752
Chemical Name: (4E)-1-hexyl-4-[hydroxy(4-methylphenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccccc1[N+](=O)[O-]

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Molecular Weight: 422.48
Empirical Formula: C24H26N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.903
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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