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canSAR1979308
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NAMES
    SMILES
    CN(CCOc1ccc(C=C2SC(O)=NC2=O)cc1)c1ccccn1
    InChI
    InChI=1S/C18H17N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,12H,10-11H2,1H3,(H,20,22,23)
    MOLECULAR FORMULA
    C18H17N3O3S
    CROSS REFERENCES
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    canSAR1979308

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.10
    AlogP 3.13
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1979308.