COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564353
Chemical Name: 2-{[3-cyano-6-hydroxy-4-(2-nitrophenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(CC(=N1)O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 452.49
Empirical Formula: C22H20N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.92
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 165
Number of rings: 3

     

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