COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034785
Chemical Name: 1-[5-tert-butyl-3-(heptafluoropropyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(2,4,6-trimethylphenoxy)ethanone
Smiles: O=C(N1N=C(CC1(O)C(C)(C)C)C(C(C(F)(F)F)(F)F)(F)F)COc1c(C)cc(cc1C)C

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Molecular Weight: 486.43
Empirical Formula: C21H25F7N2O3

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 6.857
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 2

     

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