canSAR727698
FEATURES
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NAMES
    SMILES
    CCOC(=O)c1c(-c2ccccc2)[n+]([O-])c2ccc(CN3CCN(C/C=C/c4ccccc4)CC3)cc2[n+]1[O-]
    InChI
    InChI=1S/C31H32N4O4/c1-2-39-31(36)30-29(26-13-7-4-8-14-26)34(37)27-16-15-25(22-28(27)35(30)38)23-33-20-18-32(19-21-33)17-9-12-24-10-5-3-6-11-24/h3-16,22H,2,17-21,23H2,1H3/b12-9+
    MOLECULAR FORMULA
    C31H32N4O4
    CROSS REFERENCES
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    canSAR727698
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight524.24
    AlogP3.78
    HBond donors0
    HBond acceptors8
    Atoms71
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR727698.