canSAR2094685
FEATURES
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NAMES
    SMILES
    CCN(CC)CCCCNC(=O)[C@H]1[C@H](C(=O)Nc2ccc(Br)cc2)[C@@H]2C=C[C@H]1C21CC1
    InChI
    InChI=1S/C25H34BrN3O2/c1-3-29(4-2)16-6-5-15-27-23(30)21-19-11-12-20(25(19)13-14-25)22(21)24(31)28-18-9-7-17(26)8-10-18/h7-12,19-22H,3-6,13-16H2,1-2H3,(H,27,30)(H,28,31)/t19-,20+,21-,22-/m1/s1
    MOLECULAR FORMULA
    C25H34BrN3O2
    CROSS REFERENCES
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    canSAR2094685
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight487.18
    AlogP4.45
    HBond donors2
    HBond acceptors5
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2094685.