COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376410
Chemical Name: 2-{[2-chloro-6-methoxy-4-(piperidin-1-ylcarbonothioyl)phenoxy]methyl}benzonitrile
Smiles: COc1cc(cc(c1OCc1ccccc1C#N)Cl)C(=S)N1CCCCC1

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Molecular Weight: 400.93
Empirical Formula: C21H21ClN2O2S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 4.665
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 77
Number of rings: 3

     

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