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canSAR1965654
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NAMES
    SMILES
    O=C(CCBr)NCC1=Cc2cccc(F)c2OC1(O)C(F)(F)F
    InChI
    InChI=1S/C14H12BrF4NO3/c15-5-4-11(21)20-7-9-6-8-2-1-3-10(16)12(8)23-13(9,22)14(17,18)19/h1-3,6,22H,4-5,7H2,(H,20,21)
    MOLECULAR FORMULA
    C14H12BrF4NO3
    CROSS REFERENCES
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    canSAR1965654

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.99
    AlogP 2.75
    HBond donors 2
    HBond acceptors 4
    Atoms 35
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1965654.