COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372624
Chemical Name: 4-[(4E)-4-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CCOc1cc(/C=C\2/C(=O)N(N=C2C(F)(F)F)c2ccc(cc2)C(=O)O)cc(c1O)Br

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Molecular Weight: 499.24
Empirical Formula: C20H14BrF3N2O5

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 6.172
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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