COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443532
Chemical Name: 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenoxy)propan-1-one
Smiles: CC(C(=O)N1N=C(CC1(O)C(F)(F)F)C)Oc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 361.28
Empirical Formula: C14H14F3N3O5

Physical State: Dry powder
Available Amount: 832 mg

Lipinsky:
logP: 1.404
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 2

     

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