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canSAR1523451
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NAMES
    SMILES
    C=CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cc(C)ccn2)c1
    InChI
    InChI=1S/C22H21N3O3S/c1-3-14-25(19-9-5-4-6-10-19)29(27,28)20-11-7-8-18(16-20)22(26)24-21-15-17(2)12-13-23-21/h3-13,15-16H,1,14H2,2H3,(H,23,24,26)
    MOLECULAR FORMULA
    C22H21N3O3S
    CROSS REFERENCES
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    canSAR1523451

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.13
    AlogP 4.02
    HBond donors 1
    HBond acceptors 6
    Atoms 50
    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 canSAR1523451.