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canSAR1688715
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NAMES
    SMILES
    COc1ccc(C)cc1NC(=O)CN1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1
    InChI
    InChI=1S/C23H31N3O4S/c1-17(2)19-6-8-20(9-7-19)31(28,29)26-13-11-25(12-14-26)16-23(27)24-21-15-18(3)5-10-22(21)30-4/h5-10,15,17H,11-14,16H2,1-4H3,(H,24,27)
    MOLECULAR FORMULA
    C23H31N3O4S
    CROSS REFERENCES
    1688715 logo

    canSAR1688715

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.20
    AlogP 3.07
    HBond donors 1
    HBond acceptors 7
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1688715.