COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380349
Chemical Name: methyl4-[(1,3-dimethyl-7-octyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]benzoate
Smiles: CCCCCCCCn1c(Oc2ccc(cc2)C(=O)OC)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 442.52
Empirical Formula: C23H30N4O5

Physical State: Dry powder
Available Amount: 35 mg

Lipinsky:
logP: 6.46
Rotatable bonds: 9
H-donors: 0
H-acceptors: 5
PSA: 93
Number of rings: 3

     

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