COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887220
Chemical Name: 2-{[3-cyano-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2-nitrophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2[N+](=O)[O-])NC(=O)CC1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 453.44
Empirical Formula: C20H15N5O6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.585
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 198
Number of rings: 3

     

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