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canSAR1155390
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NAMES
    SMILES
    O=C1N/C(=N\c2ccc(Cl)cc2)S/C1=C\c1cccc([N+](=O)[O-])c1
    InChI
    InChI=1S/C16H10ClN3O3S/c17-11-4-6-12(7-5-11)18-16-19-15(21)14(24-16)9-10-2-1-3-13(8-10)20(22)23/h1-9H,(H,18,19,21)/b14-9-
    MOLECULAR FORMULA
    C16H10ClN3O3S
    CROSS REFERENCES
    1155390 logo

    canSAR1155390

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 359.01
    AlogP 4.14
    HBond donors 1
    HBond acceptors 6
    Atoms 34
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1155390.