COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265538
Chemical Name: 3-methyl-7-[1-(4-methylphenyl)-1-oxobutan-2-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCC(n1cnc2c1c(=O)[nH]c(=O)n2C)C(=O)c1ccc(cc1)C

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Molecular Weight: 326.36
Empirical Formula: C17H18N4O3

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 2.097
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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