COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL513255
Chemical Name: 8-[(diethylamino)methyl]-1-hexyl-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(=O)c2n(C)c(nc2n(c1=O)C)CN(CC)CC

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Saltdata: (COOH)2
Molecular Weight: 349.48
Empirical Formula: C18H31N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.764
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 2

     

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