COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008040
Chemical Name: 8-[4-(2,4-dichlorobenzyl)piperazin-1-yl]-7-ethyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccc(cc1Cl)Cl

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Molecular Weight: 437.33
Empirical Formula: C19H22Cl2N6O2

Available Amount: 0 mg

Lipinsky:
logP: 2.31
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 4

     

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