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canSAR650716
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NAMES
    SMILES
    CN1CCN(c2cc(NCc3ccc(Cl)cc3)nc(N)n2)CC1
    InChI
    InChI=1S/C16H21ClN6/c1-22-6-8-23(9-7-22)15-10-14(20-16(18)21-15)19-11-12-2-4-13(17)5-3-12/h2-5,10H,6-9,11H2,1H3,(H3,18,19,20,21)
    MOLECULAR FORMULA
    C16H21ClN6
    CROSS REFERENCES
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    canSAR650716

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 332.15
    AlogP 2.08
    HBond donors 3
    HBond acceptors 6
    Atoms 44
    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 canSAR650716.