COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL360343
Chemical Name: (2E)-2-(acetylamino)-3-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-ethoxyphenyl}prop-2-enoicacid
Smiles: CCOc1cc(/C=C(\C(=O)O)/NC(=O)C)cc(c1OCc1ccc(cc1)Cl)Br

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Molecular Weight: 468.73
Empirical Formula: C20H19BrClNO5

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 5.236
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 2

     

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