COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363548
Chemical Name: 1-[3-butyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-methylpropan-1-one
Smiles: CCCCC1=NN(C(C1)(O)C(F)(F)F)C(=O)C(C)C

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Molecular Weight: 280.29
Empirical Formula: C12H19F3N2O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.909
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 1

     

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