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canSAR2052602
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NAMES
    SMILES
    CC/C(=C\c1ccc(Cl)cc1)C(=O)/C=C/c1cccc(OC)c1OC
    InChI
    InChI=1S/C21H21ClO3/c1-4-16(14-15-8-11-18(22)12-9-15)19(23)13-10-17-6-5-7-20(24-2)21(17)25-3/h5-14H,4H2,1-3H3/b13-10+,16-14+
    MOLECULAR FORMULA
    C21H21ClO3
    CROSS REFERENCES
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    canSAR2052602

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 356.12
    AlogP 5.43
    HBond donors 0
    HBond acceptors 3
    Atoms 46
    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 canSAR2052602.