COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958382
Chemical Name: 4-{(4Z)-4-[2-bromo-4-(2-ethoxy-2-oxoethoxy)-5-methoxybenzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: CCOC(=O)COc1cc(Br)c(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C(=O)O)C

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Molecular Weight: 517.33
Empirical Formula: C23H21BrN2O7

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.775
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 114
Number of rings: 3

     

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