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canSAR1130703
FEATURES
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NAMES
    SMILES
    COC(=O)CCCCCCCCC(=O)Oc1c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c2c1=O
    InChI
    InChI=1S/C26H28O10/c1-34-21(31)8-6-4-2-3-5-7-9-22(32)36-26-24(33)23-19(30)13-16(27)14-20(23)35-25(26)15-10-11-17(28)18(29)12-15/h10-14,27-30H,2-9H2,1H3
    MOLECULAR FORMULA
    C26H28O10
    CROSS REFERENCES
    1130703 logo

    canSAR1130703

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 500.17
    AlogP 4.48
    HBond donors 4
    HBond acceptors 10
    Atoms 64
    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 canSAR1130703.