COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK033015
Chemical Name: ethyl2-{[7-(2-amino-2-oxoethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}butanoate
Smiles: CCOC(=O)C(Sc1nc2c(n1CC(=O)N)c(=O)[nH]c(=O)n2C)CC

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Molecular Weight: 369.4
Empirical Formula: C14H19N5O5S

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 0.829
Rotatable bonds: 8
H-donors: 3
H-acceptors: 5
PSA: 161
Number of rings: 2

     

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