COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541950
Chemical Name: 3-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)-5-imino-1,7-dimethyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1C1=CCC3CC1C3(C)C)(C(C2(C#N)C#N)C)C

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Molecular Weight: 350.42
Empirical Formula: C20H22N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.167
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 113
Number of rings: 6

     

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