canSAR540165
FEATURES
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NAMES
    SMILES
    COCCc1ccc2c(c1)c1ccc3c(c1c[n+]2C)OCO3
    InChI
    InChI=1S/C18H18NO3/c1-19-10-15-13(4-6-17-18(15)22-11-21-17)14-9-12(7-8-20-2)3-5-16(14)19/h3-6,9-10H,7-8,11H2,1-2H3/q+1
    MOLECULAR FORMULA
    C18H18NO3+
    CROSS REFERENCES
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    canSAR540165
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight296.13
    AlogP2.74
    HBond donors0
    HBond acceptors4
    Atoms40
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR540165.