COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL478419
Chemical Name: 4-[(E)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl2,3,6-trichlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1c(Cl)ccc(c1Cl)Cl)/C=C(\c1ccc(cc1)Cl)/C#N

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Molecular Weight: 493.17
Empirical Formula: C23H13Cl4NO3

Available Amount: 0 mg

Lipinsky:
logP: 7.326
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 3

     

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