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canSAR1153709
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NAMES
    SMILES
    O=C(N/N=C1/c2ccccc2-c2nc3ccccc3nc21)c1ccc(Br)cc1
    InChI
    InChI=1S/C22H13BrN4O/c23-14-11-9-13(10-12-14)22(28)27-26-20-16-6-2-1-5-15(16)19-21(20)25-18-8-4-3-7-17(18)24-19/h1-12H,(H,27,28)/b26-20-
    MOLECULAR FORMULA
    C22H13BrN4O
    CROSS REFERENCES
    1153709 logo

    canSAR1153709

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.03
    AlogP 4.56
    HBond donors 1
    HBond acceptors 5
    Atoms 41
    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 canSAR1153709.