COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL223947
Chemical Name: 1-ethyl-6-imino-8-methyl-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile
Smiles: N#CC12C(=N)OC(C1C)(CC)OCC2(C#N)C#N

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Molecular Weight: 244.25
Empirical Formula: C12H12N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.865
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 113
Number of rings: 2

     

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