COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL360344
Chemical Name: (2E)-2-(acetylamino)-3-{4-[(4-bromobenzyl)oxy]-3-chloro-5-methoxyphenyl}prop-2-enoicacid
Smiles: COc1cc(/C=C(\C(=O)O)/NC(=O)C)cc(c1OCc1ccc(cc1)Br)Cl

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Molecular Weight: 454.7
Empirical Formula: C19H17BrClNO5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.916
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 2

     

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