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canSAR1205409
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NAMES
    SMILES
    COc1cc(C=C2C(=O)c3ccccc3C2=O)cc(OC)c1OCc1ccccc1
    InChI
    InChI=1S/C25H20O5/c1-28-21-13-17(12-20-23(26)18-10-6-7-11-19(18)24(20)27)14-22(29-2)25(21)30-15-16-8-4-3-5-9-16/h3-14H,15H2,1-2H3
    MOLECULAR FORMULA
    C25H20O5
    CROSS REFERENCES
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    canSAR1205409

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.13
    AlogP 4.75
    HBond donors 0
    HBond acceptors 5
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1205409.