canSAR2059146
FEATURES
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NAMES
    SMILES
    COc1ccc(OC2CCN(c3nc4ccncc4nc3NC3CC3)CC2)c(F)c1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C22H24FN5O2.C2HF3O2/c1-29-16-4-5-20(17(23)12-16)30-15-7-10-28(11-8-15)22-21(25-14-2-3-14)26-19-13-24-9-6-18(19)27-22;3-2(4,5)1(6)7/h4-6,9,12-15H,2-3,7-8,10-11H2,1H3,(H,25,26);(H,6,7)
    MOLECULAR FORMULA
    C24H25F4N5O4
    CROSS REFERENCES
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    canSAR2059146
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight523.18
    AlogP4.43
    HBond donors2
    HBond acceptors9
    Atoms62
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2059146.