COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL479903
Chemical Name: 4-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]-2-ethoxyphenyl4-[oxo(phenyl)acetyl]benzoate
Smiles: CCOC(=O)/C(=C/c1ccc(c(c1)OCC)OC(=O)c1ccc(cc1)C(=O)C(=O)c1ccccc1)/C#N

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Molecular Weight: 497.5
Empirical Formula: C29H23NO7

Available Amount: 0 mg

Lipinsky:
logP: 5.841
Rotatable bonds: 9
H-donors: 0
H-acceptors: 7
PSA: 119
Number of rings: 3

     

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