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canSAR1404488
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NAMES
    SMILES
    CCC1(C2CCN(Cc3ccccn3)CC2)NC(=O)N(CC2COc3ccccc3O2)C1=O
    InChI
    InChI=1S/C25H30N4O4/c1-2-25(18-10-13-28(14-11-18)15-19-7-5-6-12-26-19)23(30)29(24(31)27-25)16-20-17-32-21-8-3-4-9-22(21)33-20/h3-9,12,18,20H,2,10-11,13-17H2,1H3,(H,27,31)
    MOLECULAR FORMULA
    C25H30N4O4
    CROSS REFERENCES
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    canSAR1404488

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.23
    AlogP 2.83
    HBond donors 1
    HBond acceptors 8
    Atoms 63
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1404488.