COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137267
Chemical Name: 1-(2-chlorobenzyl)-8-(ethylsulfanyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCSc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1Cl

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Molecular Weight: 364.86
Empirical Formula: C16H17ClN4O2S

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 4.243
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 3

     

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