COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL342718
Chemical Name: 6-(3,4-dimethoxyphenyl)-2-[(3-oxobutan-2-yl)sulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: COc1cc(ccc1OC)c1nc(SC(C(=O)C)C)c(c(c1)C(F)(F)F)C#N

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Molecular Weight: 410.42
Empirical Formula: C19H17F3N2O3S

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 4.407
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 2

     

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