COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008101
Chemical Name: 7-(2-chlorobenzyl)-3-methyl-8-[4-(3-methylbutyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C)C

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Molecular Weight: 444.96
Empirical Formula: C22H29ClN6O2

Available Amount: 0 mg

Lipinsky:
logP: 3.351
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 4

     

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