COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417841
Chemical Name: 4-[(2-cyanobenzyl)oxy]-3-iodo-5-methoxybenzoicacid
Smiles: COc1cc(cc(c1OCc1ccccc1C#N)I)C(=O)O

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Molecular Weight: 409.18
Empirical Formula: C16H12INO4

Physical State: Dry powder
Available Amount: 2000 mg

Lipinsky:
logP: 4.189
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 79
Number of rings: 2

     

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