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canSAR2089771
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NAMES
    SMILES
    O=c1nc(OCC2CCCO2)cc2n1CCc1cc(OCc3cccc(-c4ccoc4)n3)ccc1-2
    InChI
    InChI=1S/C27H25N3O5/c31-27-29-26(35-17-22-4-2-11-33-22)14-25-23-7-6-21(13-18(23)8-10-30(25)27)34-16-20-3-1-5-24(28-20)19-9-12-32-15-19/h1,3,5-7,9,12-15,22H,2,4,8,10-11,16-17H2
    MOLECULAR FORMULA
    C27H25N3O5
    CROSS REFERENCES
    2089771 logo

    canSAR2089771

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.18
    AlogP 4.26
    HBond donors 0
    HBond acceptors 8
    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 canSAR2089771.