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canSAR1595679
FEATURES
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NAMES
    SMILES
    COc1ccccc1/C(Br)=C(/NC(=O)c1ccccc1)C(=O)N1CCCCC1
    InChI
    InChI=1S/C22H23BrN2O3/c1-28-18-13-7-6-12-17(18)19(23)20(22(27)25-14-8-3-9-15-25)24-21(26)16-10-4-2-5-11-16/h2,4-7,10-13H,3,8-9,14-15H2,1H3,(H,24,26)/b20-19-
    MOLECULAR FORMULA
    C22H23BrN2O3
    CROSS REFERENCES
    1595679 logo

    canSAR1595679

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.09
    AlogP 4.20
    HBond donors 1
    HBond acceptors 5
    Atoms 51
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1595679.