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canSAR110041
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NAMES
    SMILES
    CCCN(Cc1sc(Nc2c(CC)cccc2CC)nc1C(F)(F)F)CC1CC1
    InChI
    InChI=1S/C22H30F3N3S/c1-4-12-28(13-15-10-11-15)14-18-20(22(23,24)25)27-21(29-18)26-19-16(5-2)8-7-9-17(19)6-3/h7-9,15H,4-6,10-14H2,1-3H3,(H,26,27)
    MOLECULAR FORMULA
    C22H30F3N3S
    CROSS REFERENCES
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    canSAR110041

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.21
    AlogP 6.65
    HBond donors 1
    HBond acceptors 3
    Atoms 59
    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 canSAR110041.