COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK002905
Chemical Name: {[3-methyl-2,6-dioxo-7-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C

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Molecular Weight: 360.39
Empirical Formula: C16H16N4O4S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.46
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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