COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172392
Chemical Name: ethyl3-cyano-6-(thiophen-2-yl)-2-[(5,5,5-trifluoro-2,4-dioxopentyl)sulfanyl]pyridine-4-carboxylate
Smiles: CCOC(=O)c1cc(nc(c1C#N)SCC(=O)CC(=O)C(F)(F)F)c1cccs1

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Molecular Weight: 442.44
Empirical Formula: C18H13F3N2O4S2

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 5.731
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 150
Number of rings: 2

     

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