COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324338
Chemical Name: 3-cyano-6-hydroxy-4-(4-methoxyphenyl)-6-methyl-5-(pyridinium-1-yl)-1,4,5,6-tetrahydropyridine-2-thiolate
Smiles: COc1ccc(cc1)C1C(=C([S-])NC(C1[n+]1ccccc1)(C)O)C#N

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Molecular Weight: 353.44
Empirical Formula: C19H19N3O2S

Physical State: Dry powder
Available Amount: 206 mg

Lipinsky:
logP: -1.726
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 69
Number of rings: 3

     

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