COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843568
Chemical Name: 2-{[3-cyano-4-(2,3-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])NC(=O)CC1c1cccc(c1OC)OC

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Molecular Weight: 468.49
Empirical Formula: C22H20N4O6S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.252
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 171
Number of rings: 3

     

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