COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172623
Chemical Name: ethyl4-({[4-(2,2-dicyanoethenyl)-2-ethoxy-6-iodophenoxy]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)COc1c(I)cc(cc1OCC)C=C(C#N)C#N

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Molecular Weight: 545.33
Empirical Formula: C23H20IN3O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.092
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 121
Number of rings: 2

     

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