COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553186
Chemical Name: 2-(3-benzyl-6-hydroxy-2-oxo-2,3-dihydro-7H-purin-7-yl)-N,N-dimethylethanaminium
Smiles: C[NH+](CCn1cnc2c1c(O)nc(=O)n2Cc1ccccc1)C

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Saltdata: Cl-
Molecular Weight: 314.37
Empirical Formula: C16H20N5O2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: -0.15
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 75
Number of rings: 3

     

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