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canSAR11316
FEATURES
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NAMES
    SMILES
    CC(C)C[C@@H](CO)NC(=O)c1ccc(-c2ccccc2C(=O)Nc2cccc(C(N)=O)c2)c(C(=O)O)c1
    InChI
    InChI=1S/C28H29N3O6/c1-16(2)12-20(15-32)31-26(34)18-10-11-22(24(14-18)28(36)37)21-8-3-4-9-23(21)27(35)30-19-7-5-6-17(13-19)25(29)33/h3-11,13-14,16,20,32H,12,15H2,1-2H3,(H2,29,33)(H,30,35)(H,31,34)(H,36,37)/t20-/m0/s1
    MOLECULAR FORMULA
    C28H29N3O6
    CROSS REFERENCES
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    canSAR11316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.21
    AlogP 3.54
    HBond donors 6
    HBond acceptors 9
    Atoms 66
    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 canSAR11316.