COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044678
Chemical Name: pentyl({7-[3-(4-bromophenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl}sulfanyl)acetate
Smiles: CCCCCOC(=O)CSc1nc2c(n1CC(COc1ccc(cc1)Br)O)c(O)nc(=O)n2C

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Molecular Weight: 555.45
Empirical Formula: C22H27BrN4O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.942
Rotatable bonds: 14
H-donors: 2
H-acceptors: 6
PSA: 151
Number of rings: 3

     

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