COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL325433
Chemical Name: 3-cyano-6-oxo-5-(pyridinium-1-yl)-4-(thiophen-2-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
Smiles: N#CC1=C([S-])NC(=O)C(C1c1cccs1)[n+]1ccccc1

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Molecular Weight: 313.4
Empirical Formula: C15H11N3OS2

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: -1.531
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 3

     

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