COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL016497
Chemical Name: 3,7-dimethyl-1-(5-oxohexyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=O)CCCCn1c(=O)c2n(C)cnc2n(c1=O)C

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Molecular Weight: 278.31
Empirical Formula: C13H18N4O3

Physical State: Dry powder
Available Amount: 1010 mg

Lipinsky:
logP: 0.322
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 75
Number of rings: 2

     

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