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canSAR837106
FEATURES
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NAMES
    SMILES
    CC1(C)[C@H]2CC=C(CN3CCC(N4CC(=O)N(c5cc(F)cc(C(F)(F)F)c5)C4=O)CC3)[C@@H]1C2
    InChI
    InChI=1S/C25H29F4N3O2/c1-24(2)16-4-3-15(21(24)11-16)13-30-7-5-19(6-8-30)31-14-22(33)32(23(31)34)20-10-17(25(27,28)29)9-18(26)12-20/h3,9-10,12,16,19,21H,4-8,11,13-14H2,1-2H3/t16-,21-/m0/s1
    MOLECULAR FORMULA
    C25H29F4N3O2
    CROSS REFERENCES
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    canSAR837106

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.22
    AlogP 5.07
    HBond donors 0
    HBond acceptors 5
    Atoms 63
    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 canSAR837106.