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canSAR1685753
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NAMES
    SMILES
    Cc1cc(C(C)(C)C)cc(C)c1C[n+]1c2n(c3ccc(C(F)(F)F)cc31)CCCCC2.[Cl-]
    InChI
    InChI=1S/C26H32F3N2.ClH/c1-17-13-20(25(3,4)5)14-18(2)21(17)16-31-23-15-19(26(27,28)29)10-11-22(23)30-12-8-6-7-9-24(30)31;/h10-11,13-15H,6-9,12,16H2,1-5H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C26H32ClF3N2
    CROSS REFERENCES
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    canSAR1685753

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.22
    AlogP 3.64
    HBond donors 0
    HBond acceptors 2
    Atoms 64
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1685753.