COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047069
Chemical Name: 8-[benzyl(methyl)amino]-7-(2-chlorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccccc1Cn1c(nc2c1c(O)nc(=O)n2C)N(Cc1ccccc1)C

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Molecular Weight: 409.88
Empirical Formula: C21H20ClN5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.18
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 4

     

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