COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL010120
Chemical Name: 8-[4-(2,4-dichlorobenzyl)piperazin-1-yl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccc(cc1Cl)Cl

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Molecular Weight: 467.35
Empirical Formula: C20H24Cl2N6O3

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 1.788
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 4

     

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