COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561639
Chemical Name: 4-[(3E)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 455.38
Empirical Formula: C21H17N3O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.588
Rotatable bonds: 7
H-donors: 2
H-acceptors: 9
PSA: 186
Number of rings: 3

     

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