COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612996
Chemical Name: 8-(4-benzylpiperazin-1-yl)-3-methyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCc1ccccc1)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 444.54
Empirical Formula: C25H28N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.768
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 5

     

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