COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK057352
Chemical Name: ethyl2-{[7-(2-hydroxy-3-phenoxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}butanoate
Smiles: CCOC(=O)C(Sc1nc2c(n1CC(COc1ccccc1)O)c(=O)[nH]c(=O)n2C)CC

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Molecular Weight: 462.53
Empirical Formula: C21H26N4O6S

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 3.546
Rotatable bonds: 11
H-donors: 2
H-acceptors: 6
PSA: 148
Number of rings: 3

     

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