COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006289
Chemical Name: ethyl3-{[3-cyano-6-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}propanoate
Smiles: CCOC(=O)CCSc1nc(cc(c1C#N)C(F)(F)F)c1ccc(c(c1)OC)OC

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Molecular Weight: 440.44
Empirical Formula: C20H19F3N2O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.824
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 106
Number of rings: 2

     

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