canSAR537844
FEATURES
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NAMES
    SMILES
    C=CCOc1ccc2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1O
    InChI
    InChI=1S/C22H17NO4/c1-3-8-25-18-7-6-14-15-5-4-13-9-19-20(27-12-26-19)10-16(13)21(15)23(2)11-17(14)22(18)24/h3-7,9-11H,1,8,12H2,2H3/p+1
    MOLECULAR FORMULA
    C22H18NO4+
    CROSS REFERENCES
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    canSAR537844
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight360.12
    AlogP3.97
    HBond donors1
    HBond acceptors5
    Atoms45
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR537844.