canSAR1711362
FEATURES
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NAMES
    SMILES
    Cc1cc(C)[n+](CC(=O)Nc2ccccc2S(N)(=O)=O)c(C)c1.[O-][Cl+3]([O-])([O-])[O-]
    InChI
    InChI=1S/C16H19N3O3S.ClHO4/c1-11-8-12(2)19(13(3)9-11)10-16(20)18-14-6-4-5-7-15(14)23(17,21)22;2-1(3,4)5/h4-9H,10H2,1-3H3,(H2-,17,18,20,21,22);(H,2,3,4,5)
    MOLECULAR FORMULA
    C16H20ClN3O7S
    CROSS REFERENCES
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    canSAR1711362
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight433.07
    AlogP-3.57
    HBond donors3
    HBond acceptors10
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1711362.