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canSAR1201618
FEATURES
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NAMES
    SMILES
    CCCCC(CC)C(=O)Oc1c(Cl)c(Cl)c(C#N)c(Cl)c1Cl
    InChI
    InChI=1S/C15H15Cl4NO2/c1-3-5-6-8(4-2)15(21)22-14-12(18)10(16)9(7-20)11(17)13(14)19/h8H,3-6H2,1-2H3
    MOLECULAR FORMULA
    C15H15Cl4NO2
    CROSS REFERENCES
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    canSAR1201618

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.99
    AlogP 6.29
    HBond donors 0
    HBond acceptors 3
    Atoms 37
    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 canSAR1201618.