COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK668858
Chemical Name: (5R)-4-(3-bromo-4-fluorophenyl)-3-cyano-6-oxo-5-(pyridinium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
Smiles: N#CC1=C([S-])NC(=O)[C@@H](C1c1ccc(c(c1)Br)F)[n+]1ccccc1

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Molecular Weight: 404.26
Empirical Formula: C17H11BrFN3OS

Physical State: Dry powder
Available Amount: 16 mg

Lipinsky:
logP: -0.472
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 56
Number of rings: 3

     

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