COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL336592
Chemical Name: 4-{[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]methyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C

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Molecular Weight: 360.39
Empirical Formula: C16H16N4O4S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 2.793
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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