COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667990
Chemical Name: (4'S,5'R,6'R)-5'-(6-chloroquinolinium-1-yl)-3'-cyano-6'-hydroxy-6'-phenyl-1',4',5',6'-tetrahydro-3,4'-bipyridine-2'-thiolate
Smiles: N#CC1=C([S-])N[C@@]([C@@H]([C@H]1c1cccnc1)[n+]1cccc2c1ccc(c2)Cl)(O)c1ccccc1

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Molecular Weight: 470.98
Empirical Formula: C26H19ClN4OS

Physical State: Dry powder
Available Amount: 23 mg

Lipinsky:
logP: 0
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 72
Number of rings: 5

     

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