COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546113
Chemical Name: methyl3-{1-[2-(3,4-dihydroxyphenyl)ethyl]-4-hydroxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}-3-(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)propanoate
Smiles: COC(=O)CC(c1c(O)cc(n(c1=O)CCc1ccc(c(c1)O)O)C)c1cc2cc3OCOc3cc2nc1O

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Molecular Weight: 534.52
Empirical Formula: C28H26N2O9

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.277
Rotatable bonds: 12
H-donors: 4
H-acceptors: 9
PSA: 158
Number of rings: 5

     

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