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canSAR1443814
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NAMES
    SMILES
    Cc1cc(C)c(C(=O)Nc2ccc(S(=O)(=O)Nc3ccccn3)cc2)c(C)c1
    InChI
    InChI=1S/C21H21N3O3S/c1-14-12-15(2)20(16(3)13-14)21(25)23-17-7-9-18(10-8-17)28(26,27)24-19-6-4-5-11-22-19/h4-13H,1-3H3,(H,22,24)(H,23,25)
    MOLECULAR FORMULA
    C21H21N3O3S
    CROSS REFERENCES
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    canSAR1443814

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.13
    AlogP 4.06
    HBond donors 2
    HBond acceptors 6
    Atoms 49
    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 canSAR1443814.