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canSAR395199
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NAMES
    SMILES
    C[C@@H]1CCC2C(CNCCN)=C(C(F)(F)F)O[C@@H]3O[C@]4(C)CCC1C23OO4
    InChI
    InChI=1S/C18H27F3N2O4/c1-10-3-4-13-11(9-23-8-7-22)14(18(19,20)21)24-15-17(13)12(10)5-6-16(2,25-15)26-27-17/h10,12-13,15,23H,3-9,22H2,1-2H3/t10-,12?,13?,15-,16-,17?/m1/s1
    MOLECULAR FORMULA
    C18H27F3N2O4
    CROSS REFERENCES
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    canSAR395199

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.19
    AlogP 2.60
    HBond donors 3
    HBond acceptors 6
    Atoms 54
    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 canSAR395199.