COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007360
Chemical Name: 8-(4-benzylpiperidin-1-yl)-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)OCC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCC(CC1)Cc1ccccc1)O

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Molecular Weight: 503.6
Empirical Formula: C28H33N5O4

Available Amount: 0 mg

Lipinsky:
logP: 4.007
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 99
Number of rings: 5

     

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