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canSAR1128711
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NAMES
    SMILES
    COc1ccc(/C=C2\CNC/C(=C\c3ccc(OC)c(OC)c3)C2=O)cc1OC
    InChI
    InChI=1S/C23H25NO5/c1-26-19-7-5-15(11-21(19)28-3)9-17-13-24-14-18(23(17)25)10-16-6-8-20(27-2)22(12-16)29-4/h5-12,24H,13-14H2,1-4H3/b17-9+,18-10+
    MOLECULAR FORMULA
    C23H25NO5
    CROSS REFERENCES
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    canSAR1128711

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.17
    AlogP 3.36
    HBond donors 1
    HBond acceptors 6
    Atoms 54
    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 canSAR1128711.