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canSAR1716948
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NAMES
    SMILES
    CN1CCN(NC(=O)c2ccc(S(=O)(=O)N3CC4(C)CC3CC(C)(C)C4)cc2)CC1.Cl
    InChI
    InChI=1S/C22H34N4O3S.ClH/c1-21(2)13-18-14-22(3,15-21)16-26(18)30(28,29)19-7-5-17(6-8-19)20(27)23-25-11-9-24(4)10-12-25;/h5-8,18H,9-16H2,1-4H3,(H,23,27);1H
    MOLECULAR FORMULA
    C22H35ClN4O3S
    CROSS REFERENCES
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    canSAR1716948

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.21
    AlogP 2.59
    HBond donors 1
    HBond acceptors 7
    Atoms 66
    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 canSAR1716948.