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canSAR502123
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NAMES
    SMILES
    Cc1ccccc1C(COCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCNCC1
    InChI
    InChI=1S/C22H24F6N2O/c1-15-4-2-3-5-19(15)20(30-8-6-29-7-9-30)14-31-13-16-10-17(21(23,24)25)12-18(11-16)22(26,27)28/h2-5,10-12,20,29H,6-9,13-14H2,1H3
    MOLECULAR FORMULA
    C22H24F6N2O
    CROSS REFERENCES
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    canSAR502123

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.18
    AlogP 5.20
    HBond donors 1
    HBond acceptors 3
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR502123.