COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK101466
Chemical Name: (4E)-4-{2-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=C/2\C(=NN(C2=O)c2ccccc2)C)c(cc1OCc1ccccc1F)Br

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Molecular Weight: 495.35
Empirical Formula: C25H20BrFN2O3

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 5.999
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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