COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526960
Chemical Name: 3-methyl-7-(3-methylbenzyl)-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1

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Molecular Weight: 354.41
Empirical Formula: C18H22N6O2

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 0.882
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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