COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK571099
Chemical Name: 8-[4-(4-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(3-methylbutyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccc(cc1)Cl)C

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Molecular Weight: 444.96
Empirical Formula: C22H29ClN6O2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 2.762
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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