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canSAR1646670
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C/C(=O)c2ccc3c(c2)OCO3)cc(Cl)c1O
    InChI
    InChI=1S/C17H13ClO5/c1-21-16-7-10(6-12(18)17(16)20)2-4-13(19)11-3-5-14-15(8-11)23-9-22-14/h2-8,20H,9H2,1H3/b4-2+
    MOLECULAR FORMULA
    C17H13ClO5
    CROSS REFERENCES
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    canSAR1646670

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 332.05
    AlogP 3.68
    HBond donors 1
    HBond acceptors 5
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1646670.