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canSAR1616954
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NAMES
    SMILES
    CSc1ccc(/C=C(\NC(=O)c2ccc(C)cc2)C(=O)Nc2cccc(C)c2)cc1
    InChI
    InChI=1S/C25H24N2O2S/c1-17-7-11-20(12-8-17)24(28)27-23(16-19-9-13-22(30-3)14-10-19)25(29)26-21-6-4-5-18(2)15-21/h4-16H,1-3H3,(H,26,29)(H,27,28)/b23-16-
    MOLECULAR FORMULA
    C25H24N2O2S
    CROSS REFERENCES
    1616954 logo

    canSAR1616954

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.16
    AlogP 5.43
    HBond donors 2
    HBond acceptors 4
    Atoms 54
    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 canSAR1616954.