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canSAR563122
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NAMES
    SMILES
    Cc1c(Cl)cc(CN)c(O)c1C.Cl
    InChI
    InChI=1S/C9H12ClNO.ClH/c1-5-6(2)9(12)7(4-11)3-8(5)10;/h3,12H,4,11H2,1-2H3;1H
    MOLECULAR FORMULA
    C9H13Cl2NO
    CROSS REFERENCES
    563122 logo

    canSAR563122

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 221.04
    AlogP 2.54
    HBond donors 3
    HBond acceptors 2
    Atoms 26
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR563122.