COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034145
Chemical Name: 7-(3-chlorobenzyl)-8-(2,5-dimethylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(c(c1)Oc1nc2c(n1Cc1cccc(c1)Cl)c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 424.89
Empirical Formula: C22H21ClN4O3

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 5.804
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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