COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK596037
Chemical Name: 8-[4-(2,5-dimethylbenzyl)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)Cc1cc(C)ccc1C)C

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Molecular Weight: 438.57
Empirical Formula: C24H34N6O2

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 3.087
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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