COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149160
Chemical Name: 3-[(3E)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1cccc(c1)C(=O)O)/C=C/c1ccccc1

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Molecular Weight: 470.44
Empirical Formula: C26H18N2O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.024
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 140
Number of rings: 4

     

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