COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806016
Chemical Name: 8-(4-acetylpiperazin-1-yl)-7-(2-chlorobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=O)N1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(=O)[nH]c(=O)n2C

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Molecular Weight: 416.87
Empirical Formula: C19H21ClN6O3

Physical State: Dry powder
Available Amount: 257 mg

Lipinsky:
logP: 0.815
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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