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canSAR655044
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NAMES
    SMILES
    NC(=S)N/N=C(\c1ccc(C(F)(F)F)cc1)c1cccc(Br)c1
    InChI
    InChI=1S/C15H11BrF3N3S/c16-12-3-1-2-10(8-12)13(21-22-14(20)23)9-4-6-11(7-5-9)15(17,18)19/h1-8H,(H3,20,22,23)/b21-13+
    MOLECULAR FORMULA
    C15H11BrF3N3S
    CROSS REFERENCES
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    canSAR655044

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.98
    AlogP 4.05
    HBond donors 3
    HBond acceptors 3
    Atoms 34
    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 canSAR655044.