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canSAR1117316
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NAMES
    SMILES
    COc1cc(OC)c(Br)c(C(=O)c2c(OC)c(Cl)c(C)c(Cl)c2OC)c1Br
    InChI
    InChI=1S/C18H16Br2Cl2O5/c1-7-14(21)17(26-4)11(18(27-5)15(7)22)16(23)10-12(19)8(24-2)6-9(25-3)13(10)20/h6H,1-5H3
    MOLECULAR FORMULA
    C18H16Br2Cl2O5
    CROSS REFERENCES
    1117316 logo

    canSAR1117316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 539.87
    AlogP 6.09
    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 canSAR1117316.