COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK932802
Chemical Name: 2-(azepan-1-ylcarbonyl)-5-[(3,4-dichlorobenzyl)oxy]-4H-pyran-4-one
Smiles: O=c1cc(occ1OCc1ccc(c(c1)Cl)Cl)C(=O)N1CCCCCC1

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Molecular Weight: 396.27
Empirical Formula: C19H19Cl2NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.264
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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