COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK827659
Chemical Name: 2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2-nitrophenyl)acetamide
Smiles: CCOc1ccc(cc1)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccccc1[N+](=O)[O-]

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Molecular Weight: 452.49
Empirical Formula: C22H20N4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.301
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 162
Number of rings: 3

     

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