COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431795
Chemical Name: propyl4-[(4Z)-4-[4-(benzyloxy)-3-methoxybenzylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Smiles: CCCOC(=O)c1ccc(cc1)N1N=C(/C(=C/c2ccc(c(c2)OC)OCc2ccccc2)/C1=O)C(F)(F)F

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Molecular Weight: 538.52
Empirical Formula: C29H25F3N2O5

Physical State: Dry powder
Available Amount: 488 mg

Lipinsky:
logP: 8.089
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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