COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL159404
Chemical Name: 2-{[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]methyl}-3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one
Smiles: OCc1cc(=O)c(c(o1)CN1CCN(CC1)C1CCS(=O)(=O)C1)O

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Molecular Weight: 358.42
Empirical Formula: C15H22N2O6S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: -1.358
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 115
Number of rings: 3

     

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