canSAR1649884
FEATURES
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NAMES
    SMILES
    Cc1cc(OCC(=O)NCC(O)c2ccccc2)c2c(C)cc(=O)oc2c1
    InChI
    InChI=1S/C21H21NO5/c1-13-8-17(21-14(2)10-20(25)27-18(21)9-13)26-12-19(24)22-11-16(23)15-6-4-3-5-7-15/h3-10,16,23H,11-12H2,1-2H3,(H,22,24)
    MOLECULAR FORMULA
    C21H21NO5
    CROSS REFERENCES
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    canSAR1649884
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight367.14
    AlogP2.64
    HBond donors2
    HBond acceptors6
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1649884.