canSAR545372
FEATURES
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NAMES
    SMILES
    COc1ccc2c(ccn2CCCCCOC(=O)c2ccc[n+](C)c2)c1
    InChI
    InChI=1S/C21H25N2O3/c1-22-11-6-7-18(16-22)21(24)26-14-5-3-4-12-23-13-10-17-15-19(25-2)8-9-20(17)23/h6-11,13,15-16H,3-5,12,14H2,1-2H3/q+1
    MOLECULAR FORMULA
    C21H25N2O3+
    CROSS REFERENCES
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    canSAR545372
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight353.19
    AlogP3.50
    HBond donors0
    HBond acceptors5
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR545372.