canSAR2177839
FEATURES
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NAMES
    SMILES
    O=C(NCC1COCCO1)C1CCN(c2ccc(NC(=O)N3Cc4ccncc4C3)cc2)CC1
    InChI
    InChI=1S/C25H31N5O4/c31-24(27-14-23-17-33-11-12-34-23)18-6-9-29(10-7-18)22-3-1-21(2-4-22)28-25(32)30-15-19-5-8-26-13-20(19)16-30/h1-5,8,13,18,23H,6-7,9-12,14-17H2,(H,27,31)(H,28,32)
    MOLECULAR FORMULA
    C25H31N5O4
    CROSS REFERENCES
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    canSAR2177839
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight465.24
    AlogP2.38
    HBond donors2
    HBond acceptors9
    Atoms65
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2177839.