COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957377
Chemical Name: 4-[(4E)-4-(3,5-di-tert-butyl-4-hydroxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CC1=NN(C(=O)/C/1=C/c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c1ccc(cc1)C(=O)O

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Molecular Weight: 434.54
Empirical Formula: C26H30N2O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.83
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 90
Number of rings: 3

     

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