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canSAR1443869
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NAMES
    SMILES
    NC(=O)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1
    InChI
    InChI=1S/C12H15N3O5S/c13-12(16)9-5-7-14(8-6-9)21(19,20)11-4-2-1-3-10(11)15(17)18/h1-4,9H,5-8H2,(H2,13,16)
    MOLECULAR FORMULA
    C12H15N3O5S
    CROSS REFERENCES
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    canSAR1443869

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 313.07
    AlogP 0.48
    HBond donors 2
    HBond acceptors 8
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1443869.