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canSAR1023620
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NAMES
    SMILES
    COc1ccc(C[C@H](NC(=O)c2ccc(N)c(OCc3ccc4ccccc4c3)c2)C(=O)O)cc1
    InChI
    InChI=1S/C28H26N2O5/c1-34-23-11-7-18(8-12-23)15-25(28(32)33)30-27(31)22-10-13-24(29)26(16-22)35-17-19-6-9-20-4-2-3-5-21(20)14-19/h2-14,16,25H,15,17,29H2,1H3,(H,30,31)(H,32,33)/t25-/m0/s1
    MOLECULAR FORMULA
    C28H26N2O5
    CROSS REFERENCES
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    canSAR1023620

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.18
    AlogP 4.44
    HBond donors 4
    HBond acceptors 7
    Atoms 61
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1023620.