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canSAR1085559
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NAMES
    SMILES
    CCNCC(O)COc1ccc(C2=Cc3ccc(OCC(O)CNCC)cc3OC2)cc1
    InChI
    InChI=1S/C25H34N2O5/c1-3-26-13-21(28)16-30-23-8-5-18(6-9-23)20-11-19-7-10-24(12-25(19)32-15-20)31-17-22(29)14-27-4-2/h5-12,21-22,26-29H,3-4,13-17H2,1-2H3
    MOLECULAR FORMULA
    C25H34N2O5
    CROSS REFERENCES
    1085559 logo

    canSAR1085559

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.25
    AlogP 2.32
    HBond donors 4
    HBond acceptors 7
    Atoms 66
    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 canSAR1085559.