COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL340471
Chemical Name: 1-(4-bromobenzyl)-3,7-dimethyl-8-(pentylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccc(cc1)Br

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Molecular Weight: 434.34
Empirical Formula: C19H24BrN5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.803
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 3

     

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