COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL320041
Chemical Name: 5-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-2-hydroxy-3-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1coc(c(c1=O)CN1CCN(CC1)S(=O)(=O)C)O

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Molecular Weight: 497.01
Empirical Formula: C22H29ClN4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.027
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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