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canSAR1649840
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NAMES
    SMILES
    O=C(C[n+]1cccc(Br)c1)c1cccs1.[Br-]
    InChI
    InChI=1S/C11H9BrNOS.BrH/c12-9-3-1-5-13(7-9)8-10(14)11-4-2-6-15-11;/h1-7H,8H2;1H/q+1;/p-1
    MOLECULAR FORMULA
    C11H9Br2NOS
    CROSS REFERENCES
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    canSAR1649840

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.88
    AlogP -0.32
    HBond donors 0
    HBond acceptors 2
    Atoms 25
    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 canSAR1649840.