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canSAR1620801
FEATURES
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NAMES
    SMILES
    N#CC(C#N)=Cc1ccc(S(=O)(=O)[O-])o1
    InChI
    InChI=1S/C8H4N2O4S/c9-4-6(5-10)3-7-1-2-8(14-7)15(11,12)13/h1-3H,(H,11,12,13)/p-1
    MOLECULAR FORMULA
    C8H3N2O4S-
    CROSS REFERENCES
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    canSAR1620801

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 222.98
    AlogP 0.61
    HBond donors 0
    HBond acceptors 6
    Atoms 18
    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 canSAR1620801.