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canSAR2049273
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NAMES
    SMILES
    NCCNc1cc(N2CCN(c3cccc(Cl)c3)CC2)nc2ccccc12
    InChI
    InChI=1S/C21H24ClN5/c22-16-4-3-5-17(14-16)26-10-12-27(13-11-26)21-15-20(24-9-8-23)18-6-1-2-7-19(18)25-21/h1-7,14-15H,8-13,23H2,(H,24,25)
    MOLECULAR FORMULA
    C21H24ClN5
    CROSS REFERENCES
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    canSAR2049273

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.17
    AlogP 3.59
    HBond donors 3
    HBond acceptors 5
    Atoms 51
    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 canSAR2049273.