COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160889
Chemical Name: 2-{[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]methyl}-3-hydroxy-6-methyl-4H-pyran-4-one
Smiles: Cc1cc(=O)c(c(o1)CN1CCN(CC1)C1CCS(=O)(=O)C1)O

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Molecular Weight: 342.42
Empirical Formula: C15H22N2O5S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: -0.979
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 95
Number of rings: 3

     

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