COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526887
Chemical Name: 8-bromo-7-[2-hydroxy-3-(4-iodophenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)I

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Molecular Weight: 521.11
Empirical Formula: C15H14BrIN4O4

Physical State: Dry powder
Available Amount: 270 mg

Lipinsky:
logP: 3.433
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 96
Number of rings: 3

     

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