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Probe Reports from the NIH Molecular Libraries Program [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2010-.

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Probe Reports from the NIH Molecular Libraries Program [Internet].

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Table 1Summary of Probe (ML318) Properties Computed from Structure

IUPAC Chemical Name2-(4-fluorophenyl)-2-[6-(trifluoromethyl)pyridin-2-yl] acetonitrile
PubChem CID56604881
Molecular Weight280.220333 [g/mol]
Molecular FormulaC14H8F4N2
H-Bond Donor0
H-Bond Acceptor6
Rotatable Bond Count2
Exact Mass280.062361 [g/mol]
Topological Polar Surface Area36.7

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