COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007745
Chemical Name: 7-(3-chlorobenzyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)Cl)c(=O)[nH]c(=O)n2C

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Molecular Weight: 494.98
Empirical Formula: C25H27ClN6O3

Available Amount: 0 mg

Lipinsky:
logP: 2.52
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 5

     

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