COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054676
Chemical Name: 8-[(2-chlorobenzyl)amino]-6-hydroxy-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccccc1CNc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

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Molecular Weight: 423.9
Empirical Formula: C22H22ClN5O2

Physical State: Dry powder
Available Amount: 263 mg

Lipinsky:
logP: 4.064
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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