COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020615
Chemical Name: 8-(4-benzylpiperidin-1-yl)-7-(2,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCC(CC1)Cc1ccccc1

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Molecular Weight: 512.44
Empirical Formula: C26H27Cl2N5O2

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 5.831
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 5

     

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