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canSAR744420
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NAMES
    SMILES
    Cl.N=C(N)Nc1ccc(CCc2ccc(N)cc2)cc1
    InChI
    InChI=1S/C15H18N4.ClH/c16-13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)19-15(17)18;/h3-10H,1-2,16H2,(H4,17,18,19);1H
    MOLECULAR FORMULA
    C15H19ClN4
    CROSS REFERENCES
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    canSAR744420

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 290.13
    AlogP 2.78
    HBond donors 6
    HBond acceptors 4
    Atoms 39
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR744420.