COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539839
Chemical Name: methyl3-(4-hydroxy-3-methoxyphenyl)-3-{3-hydroxy-4-oxo-6-[(phenylsulfanyl)methyl]-4H-pyran-2-yl}propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccccc2)cc(=O)c1O)c1ccc(c(c1)OC)O

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Molecular Weight: 442.49
Empirical Formula: C23H22O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.705
Rotatable bonds: 10
H-donors: 2
H-acceptors: 7
PSA: 127
Number of rings: 3

     

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