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canSAR559411
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NAMES
    SMILES
    N=C(N)N1CCc2ccc(OCC3CCN(Cc4cccc(N)c4)CC3)cc2C1
    InChI
    InChI=1S/C23H31N5O/c24-21-3-1-2-18(12-21)14-27-9-6-17(7-10-27)16-29-22-5-4-19-8-11-28(23(25)26)15-20(19)13-22/h1-5,12-13,17H,6-11,14-16,24H2,(H3,25,26)
    MOLECULAR FORMULA
    C23H31N5O
    CROSS REFERENCES
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    canSAR559411

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.25
    AlogP 2.81
    HBond donors 5
    HBond acceptors 6
    Atoms 60
    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 canSAR559411.