COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850132
Chemical Name: (4E)-1-(2-hydroxyethyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/O)/C1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 398.37
Empirical Formula: C20H18N2O7

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 2.197
Rotatable bonds: 4
H-donors: 2
H-acceptors: 7
PSA: 132
Number of rings: 3

     

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