COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK668044
Chemical Name: 3-cyano-4-(4-nitrophenyl)-6-oxo-1-(2-phenylethyl)-5-(pyridinium-1-yl)-1,4,5,6-tetrahydropyridin-2-olate
Smiles: N#CC1=C([O-])N(CCc2ccccc2)C(=O)C(C1c1ccc(cc1)[N+](=O)[O-])[n+]1ccccc1

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Molecular Weight: 440.46
Empirical Formula: C25H20N4O4

Available Amount: 0 mg

Lipinsky:
logP: 0.186
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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