canSAR1087217
FEATURES
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NAMES
    SMILES
    O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)N1CCN(Cc2cccc(C(=O)O)c2)CC1
    InChI
    InChI=1S/C26H35N3O4/c30-23(15-26-12-19-8-20(13-26)10-21(9-19)14-26)27-16-24(31)29-6-4-28(5-7-29)17-18-2-1-3-22(11-18)25(32)33/h1-3,11,19-21H,4-10,12-17H2,(H,27,30)(H,32,33)
    MOLECULAR FORMULA
    C26H35N3O4
    CROSS REFERENCES
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    canSAR1087217
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight453.26
    AlogP2.75
    HBond donors2
    HBond acceptors7
    Atoms68
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087217.