COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548744
Chemical Name: methyl3-{1-[2-(3,4-dihydroxyphenyl)ethyl]-2-hydroxy-6-methyl-4-oxo-1,4-dihydropyridin-3-yl}-3-(7-methoxy-1,3-benzodioxol-5-yl)propanoate
Smiles: COC(=O)CC(c1c(=O)cc(n(c1O)CCc1ccc(c(c1)O)O)C)c1cc(OC)c2c(c1)OCO2

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Molecular Weight: 497.5
Empirical Formula: C26H27NO9

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.356
Rotatable bonds: 12
H-donors: 3
H-acceptors: 9
PSA: 134
Number of rings: 4

     

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