COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843456
Chemical Name: 7-(2-chlorobenzyl)-8-[(2-ethoxyethyl)sulfanyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 408.91
Empirical Formula: C18H21ClN4O3S

Physical State: Dry powder
Available Amount: 293 mg

Lipinsky:
logP: 4.253
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 92
Number of rings: 3

     

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