canSAR545723
FEATURES
Loading...
NAMES
    SMILES
    C=CCN(C)CCCCCCOc1ccc2c(-c3ccc(Br)cc3)coc2c1.O=C(O)/C=C/C(=O)O
    InChI
    InChI=1S/C24H28BrNO2.C4H4O4/c1-3-14-26(2)15-6-4-5-7-16-27-21-12-13-22-23(18-28-24(22)17-21)19-8-10-20(25)11-9-19;5-3(6)1-2-4(7)8/h3,8-13,17-18H,1,4-7,14-16H2,2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
    MOLECULAR FORMULA
    C28H32BrNO6
    CROSS REFERENCES
    Loading...
    canSAR545723
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight557.14
    AlogP6.63
    HBond donors2
    HBond acceptors7
    Atoms68
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR545723.