COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL495676
Chemical Name: 4-[(4Z)-4-[4-(diethylamino)benzylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CCN(c1ccc(cc1)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)C(=O)O)CC

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Molecular Weight: 431.41
Empirical Formula: C22H20F3N3O3

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 6.811
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 73
Number of rings: 3

     

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