COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324359
Chemical Name: 3-cyano-6-hydroxy-6-phenyl-5-(pyridinium-1-yl)-1,4,5,6-tetrahydro-4,4'-bipyridine-2-thiolate
Smiles: N#CC1=C([S-])NC(C(C1c1ccncc1)[n+]1ccccc1)(O)c1ccccc1

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Molecular Weight: 386.48
Empirical Formula: C22H18N4OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -1.573
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 72
Number of rings: 4

     

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