COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550360
Chemical Name: 3-imino-1-methyl-5-(propan-2-yl)-7-propyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: CCCC1C2(C)OC(=N)C(C1(C#N)C#N)(C(O2)C(C)C)C#N

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Molecular Weight: 300.36
Empirical Formula: C16H20N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.025
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 113
Number of rings: 3

     

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