COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK997652
Chemical Name: 8-(4-benzylpiperazin-1-yl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 444.54
Empirical Formula: C25H28N6O2

Available Amount: 0 mg

Lipinsky:
logP: 2.812
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 5

     

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