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canSAR1768983
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NAMES
    SMILES
    O=C(/C=C/c1cccc(F)c1)N1CCN(c2ncccn2)CC1
    InChI
    InChI=1S/C17H17FN4O/c18-15-4-1-3-14(13-15)5-6-16(23)21-9-11-22(12-10-21)17-19-7-2-8-20-17/h1-8,13H,9-12H2/b6-5+
    MOLECULAR FORMULA
    C17H17FN4O
    CROSS REFERENCES
    1768983 logo

    canSAR1768983

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 312.14
    AlogP 1.98
    HBond donors 0
    HBond acceptors 5
    Atoms 40
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1768983.