COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160528
Chemical Name: 2-({4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}methyl)-3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one
Smiles: OCc1oc(CN2CCN(CC2)S(=O)(=O)c2ccc(cc2)F)c(c(=O)c1)O

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Molecular Weight: 398.41
Empirical Formula: C17H19FN2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.197
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 115
Number of rings: 3

     

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