COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834931
Chemical Name: 8-(azepan-1-yl)-7-(3-bromobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1

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Molecular Weight: 446.35
Empirical Formula: C20H24BrN5O2

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 3.973
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 4

     

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