COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443533
Chemical Name: 1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitrophenoxy)propan-1-one
Smiles: CC(C(=O)N1N=C(CC1(O)C(F)F)C(F)F)Oc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 379.27
Empirical Formula: C14H13F4N3O5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 1.334
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 107
Number of rings: 2

     

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