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canSAR1061641
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NAMES
    SMILES
    COc1c(Br)cc(Br)cc1C(=O)N/N=C(\C)c1cc2ccccc2[nH]1
    InChI
    InChI=1S/C18H15Br2N3O2/c1-10(16-7-11-5-3-4-6-15(11)21-16)22-23-18(24)13-8-12(19)9-14(20)17(13)25-2/h3-9,21H,1-2H3,(H,23,24)/b22-10+
    MOLECULAR FORMULA
    C18H15Br2N3O2
    CROSS REFERENCES
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    canSAR1061641

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.95
    AlogP 4.86
    HBond donors 2
    HBond acceptors 5
    Atoms 40
    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 canSAR1061641.