COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042205
Chemical Name: 6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-2H-purin-2-one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(=O)c1ccccc1)c(O)nc(=O)n2C

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Molecular Weight: 412.45
Empirical Formula: C20H24N6O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: -0.102
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 114
Number of rings: 4

     

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