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canSAR91489
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NAMES
    SMILES
    Clc1ccc(N2CCN(Cc3cnn4c(I)cccc34)CC2)cc1
    InChI
    InChI=1S/C18H18ClIN4/c19-15-4-6-16(7-5-15)23-10-8-22(9-11-23)13-14-12-21-24-17(14)2-1-3-18(24)20/h1-7,12H,8-11,13H2
    MOLECULAR FORMULA
    C18H18ClIN4
    CROSS REFERENCES
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    canSAR91489

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.03
    AlogP 3.91
    HBond donors 0
    HBond acceptors 4
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR91489.