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canSAR1443337
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NAMES
    SMILES
    Cc1ccc(NC2=NC(=O)/C(=C\c3ccc(C)s3)S2)cc1
    InChI
    InChI=1S/C16H14N2OS2/c1-10-3-6-12(7-4-10)17-16-18-15(19)14(21-16)9-13-8-5-11(2)20-13/h3-9H,1-2H3,(H,17,18,19)/b14-9+
    MOLECULAR FORMULA
    C16H14N2OS2
    CROSS REFERENCES
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    canSAR1443337

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 314.05
    AlogP 4.45
    HBond donors 1
    HBond acceptors 3
    Atoms 35
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1443337.