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canSAR498707
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NAMES
    SMILES
    COc1ccc2c(c1)c(CCCC(=O)N1CCOCC1)c(C)n2C(=O)c1ccc(Cl)cc1
    InChI
    InChI=1S/C25H27ClN2O4/c1-17-21(4-3-5-24(29)27-12-14-32-15-13-27)22-16-20(31-2)10-11-23(22)28(17)25(30)18-6-8-19(26)9-7-18/h6-11,16H,3-5,12-15H2,1-2H3
    MOLECULAR FORMULA
    C25H27ClN2O4
    CROSS REFERENCES
    498707 logo

    canSAR498707

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.17
    AlogP 4.48
    HBond donors 0
    HBond acceptors 6
    Atoms 59
    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 canSAR498707.