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canSAR500301
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NAMES
    SMILES
    O=C1Nc2cc(Br)ccc2/C1=C1/Nc2ccccc2/C1=N/O
    InChI
    InChI=1S/C16H10BrN3O2/c17-8-5-6-9-12(7-8)19-16(21)13(9)15-14(20-22)10-3-1-2-4-11(10)18-15/h1-7,18,22H,(H,19,21)/b15-13-,20-14-
    MOLECULAR FORMULA
    C16H10BrN3O2
    CROSS REFERENCES
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    canSAR500301

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.00
    AlogP 3.42
    HBond donors 3
    HBond acceptors 5
    Atoms 32
    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 canSAR500301.