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canSAR1590989
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NAMES
    SMILES
    O=C(O)CCCNC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccccc1Br
    InChI
    InChI=1S/C20H18BrClN2O4/c21-16-5-2-1-4-15(16)19(27)24-17(12-13-7-9-14(22)10-8-13)20(28)23-11-3-6-18(25)26/h1-2,4-5,7-10,12H,3,6,11H2,(H,23,28)(H,24,27)(H,25,26)/b17-12+
    MOLECULAR FORMULA
    C20H18BrClN2O4
    CROSS REFERENCES
    1590989 logo

    canSAR1590989

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.01
    AlogP 3.85
    HBond donors 3
    HBond acceptors 6
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1590989.