COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667364
Chemical Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine
Smiles: Brc1cc2OCOc2cc1CN1CCN(CC1)c1ccc(cc1C(F)(F)F)[N+](=O)[O-]

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Molecular Weight: 488.26
Empirical Formula: C19H17BrF3N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.909
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 70
Number of rings: 4

     

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