COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL342901
Chemical Name: 8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C

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Molecular Weight: 442.52
Empirical Formula: C22H30N6O4

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 1.684
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 94
Number of rings: 4

     

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