COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK200944
Chemical Name: 4-({2-chloro-4-[(E)-2-cyano-2-(4-fluorophenyl)ethenyl]-6-ethoxyphenoxy}methyl)benzoicacid
Smiles: CCOc1cc(/C=C(\c2ccc(cc2)F)/C#N)cc(c1OCc1ccc(cc1)C(=O)O)Cl

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Molecular Weight: 451.88
Empirical Formula: C25H19ClFNO4

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 6.971
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 79
Number of rings: 3

     

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