COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL146920
Chemical Name: 7-(2,6-dichlorobenzyl)-8-[(4-hydroxybutan-2-yl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCC(Nc1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 426.3
Empirical Formula: C18H21Cl2N5O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.045
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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