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canSAR115051
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NAMES
    SMILES
    Cn1cc(C2=C(c3cn(CCCCCO)c4ccccc34)C(=O)NC2=O)c2ccccc21
    InChI
    InChI=1S/C26H25N3O3/c1-28-15-19(17-9-3-5-11-21(17)28)23-24(26(32)27-25(23)31)20-16-29(13-7-2-8-14-30)22-12-6-4-10-18(20)22/h3-6,9-12,15-16,30H,2,7-8,13-14H2,1H3,(H,27,31,32)
    MOLECULAR FORMULA
    C26H25N3O3
    CROSS REFERENCES
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    canSAR115051

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.19
    AlogP 3.86
    HBond donors 2
    HBond acceptors 6
    Atoms 57
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR115051.