COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL153582
Chemical Name: 2-{[4-(3,4-dichlorophenyl)piperazin-1-yl]methyl}-3-hydroxy-6-(hydroxymethyl)-4H-pyran-4-one
Smiles: OCc1cc(=O)c(c(o1)CN1CCN(CC1)c1ccc(c(c1)Cl)Cl)O

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Molecular Weight: 385.25
Empirical Formula: C17H18Cl2N2O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.698
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 73
Number of rings: 3

     

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