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canSAR498566
FEATURES
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NAMES
    SMILES
    CC(C)C(NC(=O)Cn1c(Cc2ccccc2)ccc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F
    InChI
    InChI=1S/C28H28F3N3O5/c1-18(2)24(25(36)28(29,30)31)33-23(35)16-34-21(15-19-9-5-3-6-10-19)13-14-22(26(34)37)32-27(38)39-17-20-11-7-4-8-12-20/h3-14,18,24H,15-17H2,1-2H3,(H,32,38)(H,33,35)
    MOLECULAR FORMULA
    C28H28F3N3O5
    CROSS REFERENCES
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    canSAR498566

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 543.20
    AlogP 4.46
    HBond donors 2
    HBond acceptors 8
    Atoms 67
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR498566.