COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050978
Chemical Name: 8-[bis(2-hydroxyethyl)amino]-6-hydroxy-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-2-one
Smiles: OCCN(c1nc2c(n1CCOc1ccccc1)c(O)nc(=O)n2C)CCO

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Molecular Weight: 389.41
Empirical Formula: C18H23N5O5

Physical State: Dry powder
Available Amount: 266 mg

Lipinsky:
logP: -0.305
Rotatable bonds: 10
H-donors: 3
H-acceptors: 5
PSA: 123
Number of rings: 3

     

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