COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK074072
Chemical Name: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-3-methyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(S)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Br

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Molecular Weight: 427.28
Empirical Formula: C15H15BrN4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.575
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 135
Number of rings: 3

     

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