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canSAR1121697
FEATURES
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NAMES
    SMILES
    COc1cc(C2NC(=O)NC(C)=C2C(=O)OCc2ccc3c(c2)OCO3)ccc1OCc1ccccc1
    InChI
    InChI=1S/C28H26N2O7/c1-17-25(27(31)35-15-19-8-10-22-24(12-19)37-16-36-22)26(30-28(32)29-17)20-9-11-21(23(13-20)33-2)34-14-18-6-4-3-5-7-18/h3-13,26H,14-16H2,1-2H3,(H2,29,30,32)
    MOLECULAR FORMULA
    C28H26N2O7
    CROSS REFERENCES
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    canSAR1121697

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.17
    AlogP 4.37
    HBond donors 2
    HBond acceptors 9
    Atoms 63
    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 canSAR1121697.