COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL317173
Chemical Name: methyl3-(3-chloro-4-hydroxyphenyl)-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)Cl)O

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Molecular Weight: 446.91
Empirical Formula: C22H19ClO6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.556
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 118
Number of rings: 3

     

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