canSAR1087554
FEATURES
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NAMES
    SMILES
    CCNC(=O)OCc1c(COC(=O)NC(C)C)c2n(c1C)Cc1c(c3ccccc3n1C)C2
    InChI
    InChI=1S/C25H32N4O4/c1-6-26-24(30)32-13-19-16(4)29-12-23-18(17-9-7-8-10-21(17)28(23)5)11-22(29)20(19)14-33-25(31)27-15(2)3/h7-10,15H,6,11-14H2,1-5H3,(H,26,30)(H,27,31)
    MOLECULAR FORMULA
    C25H32N4O4
    CROSS REFERENCES
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    canSAR1087554
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight452.24
    AlogP4.12
    HBond donors2
    HBond acceptors8
    Atoms65
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087554.