COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434591
Chemical Name: methyl3-(6-{[(4-chlorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propanoate
Smiles: COC(=O)CC(c1cc(OC)c2c(c1OC)OCO2)c1oc(CSc2ccc(cc2)Cl)cc(=O)c1O

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Molecular Weight: 534.97
Empirical Formula: C25H23ClO9S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.006
Rotatable bonds: 10
H-donors: 1
H-acceptors: 9
PSA: 135
Number of rings: 4

     

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