COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078833
Chemical Name: 4-{2-[(3-methyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]ethoxy}benzoicacid
Smiles: CCCn1c(SCCOc2ccc(cc2)C(=O)O)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 404.45
Empirical Formula: C18H20N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 3.436
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 139
Number of rings: 3

     

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