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canSAR349944
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NAMES
    SMILES
    COc1cc(OC)c(OC)cc1C[S+]([O-])c1ncccc1C(=O)Nc1ccncc1
    InChI
    InChI=1S/C21H21N3O5S/c1-27-17-12-19(29-3)18(28-2)11-14(17)13-30(26)21-16(5-4-8-23-21)20(25)24-15-6-9-22-10-7-15/h4-12H,13H2,1-3H3,(H,22,24,25)
    MOLECULAR FORMULA
    C21H21N3O5S
    CROSS REFERENCES
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    canSAR349944

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.12
    AlogP 3.06
    HBond donors 1
    HBond acceptors 8
    Atoms 51
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR349944.