COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK488744
Chemical Name: 2-(3,4-dimethylphenoxy)-1-[4-(pyridin-2-yl)piperazin-1-yl]butan-1-one
Smiles: CCC(C(=O)N1CCN(CC1)c1ccccn1)Oc1ccc(c(c1)C)C

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Molecular Weight: 353.46
Empirical Formula: C21H27N3O2

Physical State: Liquid
Available Amount: 350 mg

Lipinsky:
logP: 3.157
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 45
Number of rings: 3

     

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