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canSAR1647823
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NAMES
    SMILES
    O=C(O)CCc1ccc(-c2cccs2)n1CCc1ccccc1
    InChI
    InChI=1S/C19H19NO2S/c21-19(22)11-9-16-8-10-17(18-7-4-14-23-18)20(16)13-12-15-5-2-1-3-6-15/h1-8,10,14H,9,11-13H2,(H,21,22)
    MOLECULAR FORMULA
    C19H19NO2S
    CROSS REFERENCES
    1647823 logo

    canSAR1647823

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.11
    AlogP 4.48
    HBond donors 1
    HBond acceptors 3
    Atoms 42
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1647823.