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canSAR2018954
FEATURES
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NAMES
    SMILES
    COc1cc(C(=C2C(=O)C(=O)c3ccccc3C2=O)c2c(O)c(O)c3ccccc3c2O)cc(OC)c1OC
    InChI
    InChI=1S/C30H22O9/c1-37-19-12-14(13-20(38-2)30(19)39-3)21(22-24(31)15-8-4-6-10-17(15)26(33)28(22)35)23-25(32)16-9-5-7-11-18(16)27(34)29(23)36/h4-13,31,33,35H,1-3H3
    MOLECULAR FORMULA
    C30H22O9
    CROSS REFERENCES
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    canSAR2018954

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 526.13
    AlogP 4.43
    HBond donors 3
    HBond acceptors 9
    Atoms 61
    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 canSAR2018954.