COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK765936
Chemical Name: 8-(azepan-1-yl)-7-[2-(4-bromophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1

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Molecular Weight: 474.36
Empirical Formula: C21H24BrN5O3

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.668
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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