COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL545905
Chemical Name: methyl3-{1-[2-(3,4-dihydroxyphenyl)ethyl]-2-hydroxy-6-methyl-4-oxo-1,4-dihydropyridin-3-yl}-3-[4-(methylsulfanyl)phenyl]propanoate
Smiles: COC(=O)CC(c1c(=O)cc(n(c1O)CCc1ccc(c(c1)O)O)C)c1ccc(cc1)SC

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Molecular Weight: 469.56
Empirical Formula: C25H27NO6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.813
Rotatable bonds: 10
H-donors: 3
H-acceptors: 6
PSA: 132
Number of rings: 3

     

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