COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL349349
Chemical Name: 8-(azepan-1-yl)-1,3-dimethyl-7-(1-oxo-1-phenylbutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCC(n1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1)C(=O)c1ccccc1

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Molecular Weight: 423.52
Empirical Formula: C23H29N5O3

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 3.781
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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