COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL480472
Chemical Name: 4-[(1E)-2-cyano-3-methoxy-3-oxoprop-1-en-1-yl]-2-methoxyphenyl3-methyl-4-nitrobenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(c(c1)C)[N+](=O)[O-])/C(=O)OC

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Molecular Weight: 396.36
Empirical Formula: C20H16N2O7

Available Amount: 0 mg

Lipinsky:
logP: 3.609
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 131
Number of rings: 2

     

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