COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL343292
Chemical Name: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C

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Molecular Weight: 458.52
Empirical Formula: C22H30N6O5

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.886
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 114
Number of rings: 4

     

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