COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK234885
Chemical Name: 7-(2-ethylhexyl)-1,3-dimethyl-8-phenoxy-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCC(Cn1c(Oc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C)CC

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Molecular Weight: 384.48
Empirical Formula: C21H28N4O3

Physical State: Dry powder
Available Amount: 123 mg

Lipinsky:
logP: 6.048
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 3

     

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