COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838449
Chemical Name: methyl2-[(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]propanoate
Smiles: COC(=O)C(Sc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 388.45
Empirical Formula: C18H20N4O4S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.564
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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