canSAR858306
FEATURES
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NAMES
    SMILES
    Cn1cc[n+](C)c1C(O)c1ccc(NS(C)(=O)=O)cc1.[I-]
    InChI
    InChI=1S/C13H18N3O3S.HI/c1-15-8-9-16(2)13(15)12(17)10-4-6-11(7-5-10)14-20(3,18)19;/h4-9,12,14,17H,1-3H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C13H18IN3O3S
    CROSS REFERENCES
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    canSAR858306
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight423.01
    AlogP-2.69
    HBond donors2
    HBond acceptors6
    Atoms39
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR858306.