COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034903
Chemical Name: 1-(2,4-dichlorobenzyl)-8-(2,5-dimethylphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)Cl)Cn1c(=O)c2n(C)c(nc2n(c1=O)C)Oc1cc(C)ccc1C

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Molecular Weight: 459.33
Empirical Formula: C22H20Cl2N4O3

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 6.411
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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