COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK558760
Chemical Name: 1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=O)C(n1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 361.44
Empirical Formula: C18H27N5O3

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 1.081
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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