COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL311269
Chemical Name: methyl3-{3-hydroxy-4-oxo-6-[(phenylsulfanyl)methyl]-4H-pyran-2-yl}-3-(quinolin-6-yl)propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccccc2)cc(=O)c1O)c1ccc2c(c1)cccn2

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Molecular Weight: 447.51
Empirical Formula: C25H21NO5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.602
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 4

     

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