COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044097
Chemical Name: 8-[(2-chloro-6-fluorobenzyl)sulfanyl]-6-hydroxy-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: Fc1cccc(c1CSc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C)Cl

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Molecular Weight: 458.94
Empirical Formula: C22H20ClFN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.886
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 4

     

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