COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK033676
Chemical Name: ethyl4-[(4Z)-4-(4-butoxy-3-methoxybenzylidene)-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Smiles: CCCCOc1ccc(cc1OC)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)C(=O)OCC

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Molecular Weight: 490.48
Empirical Formula: C25H25F3N2O5

Available Amount: 0 mg

Lipinsky:
logP: 7.496
Rotatable bonds: 8
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 3

     

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