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canSAR1769268
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NAMES
    SMILES
    CCC(O)C1CCN(Cc2cn(Cc3ccccc3)nc2-c2cc3ccccc3o2)CC1
    InChI
    InChI=1S/C27H31N3O2/c1-2-24(31)21-12-14-29(15-13-21)18-23-19-30(17-20-8-4-3-5-9-20)28-27(23)26-16-22-10-6-7-11-25(22)32-26/h3-11,16,19,21,24,31H,2,12-15,17-18H2,1H3
    MOLECULAR FORMULA
    C27H31N3O2
    CROSS REFERENCES
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    canSAR1769268

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.24
    AlogP 5.33
    HBond donors 1
    HBond acceptors 5
    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 canSAR1769268.