canSAR946988
FEATURES
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NAMES
    SMILES
    O=C(c1cc(-c2ccc(Cl)cc2)n[nH]1)N1CCN(Cc2ccccn2)CC1
    InChI
    InChI=1S/C20H20ClN5O/c21-16-6-4-15(5-7-16)18-13-19(24-23-18)20(27)26-11-9-25(10-12-26)14-17-3-1-2-8-22-17/h1-8,13H,9-12,14H2,(H,23,24)
    MOLECULAR FORMULA
    C20H20ClN5O
    CROSS REFERENCES
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    canSAR946988
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight381.14
    AlogP3.08
    HBond donors1
    HBond acceptors6
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR946988.