COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564482
Chemical Name: 6-hydroxy-8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN1CCN(CC1)c1nc2c(n1CC(COc1ccccc1)O)c(O)nc(=O)n2C

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Molecular Weight: 444.49
Empirical Formula: C21H28N6O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.175
Rotatable bonds: 8
H-donors: 3
H-acceptors: 5
PSA: 126
Number of rings: 4

     

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