COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL461742
Chemical Name: 4-butyl-8-methyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2H-chromen-2-one
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 395.41
Empirical Formula: C22H21NO6

Available Amount: 0 mg

Lipinsky:
logP: 5.326
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 98
Number of rings: 3

     

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