COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL296054
Chemical Name: 7-(2-chlorobenzyl)-8-[(4-hydroxybutyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCCCNc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 391.86
Empirical Formula: C18H22ClN5O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.392
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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