canSAR2195521
FEATURES
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NAMES
    SMILES
    CCO[C@@H](Cc1ccc(OCc2cc(CO)ccn2)cc1)C(=O)NO
    InChI
    InChI=1S/C18H22N2O5/c1-2-24-17(18(22)20-23)10-13-3-5-16(6-4-13)25-12-15-9-14(11-21)7-8-19-15/h3-9,17,21,23H,2,10-12H2,1H3,(H,20,22)/t17-/m0/s1
    MOLECULAR FORMULA
    C18H22N2O5
    CROSS REFERENCES
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    canSAR2195521
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight346.15
    AlogP1.61
    HBond donors3
    HBond acceptors7
    Atoms47
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2195521.