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canSAR1130858
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NAMES
    SMILES
    O=C1C(Nc2ccc([N+](=O)[O-])cc2Cl)=CC2=NS(=O)(=O)c3cccc1c32
    InChI
    InChI=1S/C16H8ClN3O5S/c17-10-6-8(20(22)23)4-5-11(10)18-13-7-12-15-9(16(13)21)2-1-3-14(15)26(24,25)19-12/h1-7,18H
    MOLECULAR FORMULA
    C16H8ClN3O5S
    CROSS REFERENCES
    1130858 logo

    canSAR1130858

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.99
    AlogP 2.93
    HBond donors 1
    HBond acceptors 8
    Atoms 34
    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 canSAR1130858.