COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038947
Chemical Name: 3-[(3E)-3-[hydroxy(phenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 396.36
Empirical Formula: C20H16N2O7

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 2.685
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 140
Number of rings: 3

     

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