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canSAR164975
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NAMES
    SMILES
    COc1ccc(Nc2nc(N)c(C(=O)c3ccc(Br)cc3)s2)cc1
    InChI
    InChI=1S/C17H14BrN3O2S/c1-23-13-8-6-12(7-9-13)20-17-21-16(19)15(24-17)14(22)10-2-4-11(18)5-3-10/h2-9H,19H2,1H3,(H,20,21)
    MOLECULAR FORMULA
    C17H14BrN3O2S
    CROSS REFERENCES
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    canSAR164975

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.00
    AlogP 4.47
    HBond donors 3
    HBond acceptors 5
    Atoms 38
    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 canSAR164975.