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canSAR1131776
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NAMES
    SMILES
    O=c1c2cccc3c(Nc4ccc(Br)cn4)ccc(c32)c2nc3ccccc3n12
    InChI
    InChI=1S/C23H13BrN4O/c24-13-8-11-20(25-12-13)26-17-10-9-15-21-14(17)4-3-5-16(21)23(29)28-19-7-2-1-6-18(19)27-22(15)28/h1-12H,(H,25,26)
    MOLECULAR FORMULA
    C23H13BrN4O
    CROSS REFERENCES
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    canSAR1131776

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.03
    AlogP 5.49
    HBond donors 1
    HBond acceptors 5
    Atoms 42
    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 canSAR1131776.