COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045949
Chemical Name: ethyl4-[(3Z)-3-[hydroxy(4-nitrophenyl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=O)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C1c1ccc(cc1)OC

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Molecular Weight: 502.48
Empirical Formula: C27H22N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.012
Rotatable bonds: 3
H-donors: 1
H-acceptors: 8
PSA: 138
Number of rings: 4

     

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