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canSAR1687079
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NAMES
    SMILES
    COc1ccc(OC)c(N(CC(=O)NCc2ccncc2)S(C)(=O)=O)c1
    InChI
    InChI=1S/C17H21N3O5S/c1-24-14-4-5-16(25-2)15(10-14)20(26(3,22)23)12-17(21)19-11-13-6-8-18-9-7-13/h4-10H,11-12H2,1-3H3,(H,19,21)
    MOLECULAR FORMULA
    C17H21N3O5S
    CROSS REFERENCES
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    canSAR1687079

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 379.12
    AlogP 1.18
    HBond donors 1
    HBond acceptors 8
    Atoms 47
    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 canSAR1687079.