COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL477897
Chemical Name: 4-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]-2-ethoxyphenyl4-nitrobenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-])/C=C(/C(=O)OCC)\C#N

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Molecular Weight: 410.38
Empirical Formula: C21H18N2O7

Available Amount: 0 mg

Lipinsky:
logP: 4.211
Rotatable bonds: 8
H-donors: 0
H-acceptors: 7
PSA: 131
Number of rings: 2

     

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