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canSAR463718
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NAMES
    SMILES
    O=C(/C=C/c1cccc([N+](=O)[O-])c1)c1cc(Cl)sc1Cl
    InChI
    InChI=1S/C13H7Cl2NO3S/c14-12-7-10(13(15)20-12)11(17)5-4-8-2-1-3-9(6-8)16(18)19/h1-7H/b5-4+
    MOLECULAR FORMULA
    C13H7Cl2NO3S
    CROSS REFERENCES
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    canSAR463718

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 326.95
    AlogP 4.86
    HBond donors 0
    HBond acceptors 4
    Atoms 27
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR463718.