canSAR117232
FEATURES
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NAMES
    SMILES
    CCN(CC)Cc1cc(Nc2cc[n+]([O-])c3cc(Cl)ccc23)cc(CN(CC)CC)c1O
    InChI
    InChI=1S/C25H33ClN4O2/c1-5-28(6-2)16-18-13-21(14-19(25(18)31)17-29(7-3)8-4)27-23-11-12-30(32)24-15-20(26)9-10-22(23)24/h9-15,27,31H,5-8,16-17H2,1-4H3
    MOLECULAR FORMULA
    C25H33ClN4O2
    CROSS REFERENCES
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    canSAR117232
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight456.23
    AlogP5.26
    HBond donors2
    HBond acceptors6
    Atoms65
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR117232.