COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526890
Chemical Name: 3-imino-5-(4-methoxyphenyl)-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccc(cc1)OC)(C(C2(C#N)C#N)c1ccccc1)C

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Molecular Weight: 398.42
Empirical Formula: C23H18N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.687
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 122
Number of rings: 5

     

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