COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK442183
Chemical Name: 2,2,3,3,4,4,5,5,5-nonafluoro-1-[4-(4-nitrophenyl)piperazin-1-yl]pentan-1-one
Smiles: [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

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Molecular Weight: 453.26
Empirical Formula: C15H12F9N3O3

Physical State: Dry powder
Available Amount: 720 mg

Lipinsky:
logP: 6.954
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 2

     

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