COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675137
Chemical Name: (4S,5R,6R)-3-cyano-4-(2-fluorophenyl)-6-hydroxy-6-phenyl-5-(pyridinium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
Smiles: N#CC1=C([S-])N[C@@]([C@@H]([C@H]1c1ccccc1F)[n+]1ccccc1)(O)c1ccccc1

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Molecular Weight: 403.48
Empirical Formula: C23H18FN3OS

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: -0.03
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 59
Number of rings: 4

     

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