COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826338
Chemical Name: ethyl5-cyano-6-[(4-ethoxy-2,4-dioxobutyl)sulfanyl]-4-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)CC(=O)CSC1=C(C#N)C(C(C(=O)N1)C(=O)OCC)c1ccccc1F

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Molecular Weight: 448.47
Empirical Formula: C21H21FN2O6S

Physical State: Dry powder
Available Amount: 331 mg

Lipinsky:
logP: 5.28
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 147
Number of rings: 2

     

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