COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL311206
Chemical Name: methyl3-(6-{[(2-chlorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(4-hydroxyphenyl)propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccccc2Cl)cc(=O)c1O)c1ccc(cc1)O

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Molecular Weight: 446.91
Empirical Formula: C22H19ClO6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.758
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 118
Number of rings: 3

     

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