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canSAR1063753
FEATURES
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NAMES
    SMILES
    O=C1O[C@]2(CN3CCC2CC3)CN1c1ccc2c(c1)OCCO2
    InChI
    InChI=1S/C17H20N2O4/c20-16-19(13-1-2-14-15(9-13)22-8-7-21-14)11-17(23-16)10-18-5-3-12(17)4-6-18/h1-2,9,12H,3-8,10-11H2/t17-/m1/s1
    MOLECULAR FORMULA
    C17H20N2O4
    CROSS REFERENCES
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    canSAR1063753

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 316.14
    AlogP 1.88
    HBond donors 0
    HBond acceptors 6
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1063753.