COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541288
Chemical Name: ethyl2-[(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]propanoate
Smiles: CCOC(=O)C(Sc1nc2c(n1CC)c(=O)[nH]c(=O)n2C)C

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Molecular Weight: 326.38
Empirical Formula: C13H18N4O4S

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 2.14
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 2

     

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