COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK697869
Chemical Name: 8-(1,3-benzodioxol-5-ylmethoxy)-1-(2,4-dichlorobenzyl)-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)OCc1ccc2c(c1)OCO2

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Molecular Weight: 489.31
Empirical Formula: C22H18Cl2N4O5

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 5.377
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 86
Number of rings: 5

     

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