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canSAR93051
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NAMES
    SMILES
    COc1ccccc1NC(=S)NCc1ccco1
    InChI
    InChI=1S/C13H14N2O2S/c1-16-12-7-3-2-6-11(12)15-13(18)14-9-10-5-4-8-17-10/h2-8H,9H2,1H3,(H2,14,15,18)
    MOLECULAR FORMULA
    C13H14N2O2S
    CROSS REFERENCES
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    canSAR93051

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 262.08
    AlogP 2.77
    HBond donors 2
    HBond acceptors 4
    Atoms 32
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR93051.