COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172372
Chemical Name: (4Z)-4-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=C\2/C(=NN(C2=O)c2cccc(c2)C(F)(F)F)C)cc(c1OCc1ccccc1Cl)Br

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Molecular Weight: 579.8
Empirical Formula: C26H19BrClF3N2O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.715
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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