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canSAR1202962
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NAMES
    SMILES
    COc1cc(/C=C/C(=O)N2CCC=C(Cl)C2=O)cc(OC)c1OC
    InChI
    InChI=1S/C17H18ClNO5/c1-22-13-9-11(10-14(23-2)16(13)24-3)6-7-15(20)19-8-4-5-12(18)17(19)21/h5-7,9-10H,4,8H2,1-3H3/b7-6+
    MOLECULAR FORMULA
    C17H18ClNO5
    CROSS REFERENCES
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    canSAR1202962

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.09
    AlogP 2.61
    HBond donors 0
    HBond acceptors 6
    Atoms 42
    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 canSAR1202962.