COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045925
Chemical Name: 1-[5-tert-butyl-3-(heptafluoropropyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethanone
Smiles: O=C(N1N=C(CC1(O)C(C)(C)C)C(C(C(F)(F)F)(F)F)(F)F)Cc1ccccc1

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Molecular Weight: 428.35
Empirical Formula: C18H19F7N2O2

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 5.583
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 2

     

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