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canSAR1633005
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NAMES
    SMILES
    O=C(Cc1ccc(Br)cc1)Nc1nc2ccccc2[nH]1
    InChI
    InChI=1S/C15H12BrN3O/c16-11-7-5-10(6-8-11)9-14(20)19-15-17-12-3-1-2-4-13(12)18-15/h1-8H,9H2,(H2,17,18,19,20)
    MOLECULAR FORMULA
    C15H12BrN3O
    CROSS REFERENCES
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    canSAR1633005

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.02
    AlogP 3.51
    HBond donors 2
    HBond acceptors 4
    Atoms 32
    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 canSAR1633005.