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canSAR504257
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NAMES
    SMILES
    O=C1NC(=S)S/C1=C\CCc1ccccc1
    InChI
    InChI=1S/C12H11NOS2/c14-11-10(16-12(15)13-11)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2,(H,13,14,15)/b10-8-
    MOLECULAR FORMULA
    C12H11NOS2
    CROSS REFERENCES
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    canSAR504257

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 249.03
    AlogP 2.65
    HBond donors 1
    HBond acceptors 2
    Atoms 27
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR504257.