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canSAR1131828
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NAMES
    SMILES
    O=C(Cc1ccc(Br)cc1)OCCOC1=C(c2ccc(Cl)cc2)C(=O)OC1
    InChI
    InChI=1S/C20H16BrClO5/c21-15-5-1-13(2-6-15)11-18(23)26-10-9-25-17-12-27-20(24)19(17)14-3-7-16(22)8-4-14/h1-8H,9-12H2
    MOLECULAR FORMULA
    C20H16BrClO5
    CROSS REFERENCES
    1131828 logo

    canSAR1131828

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.99
    AlogP 4.17
    HBond donors 0
    HBond acceptors 5
    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 canSAR1131828.