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canSAR1123870
FEATURES
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NAMES
    SMILES
    CC(C)N1C(=O)[C@H](NC(=O)[C@@H](Cc2ccccc2OC(F)(F)F)NC(=O)OC(C)(C)C)CCc2cc(F)cc(F)c21
    InChI
    InChI=1S/C28H32F5N3O5/c1-15(2)36-23-17(12-18(29)14-19(23)30)10-11-20(25(36)38)34-24(37)21(35-26(39)41-27(3,4)5)13-16-8-6-7-9-22(16)40-28(31,32)33/h6-9,12,14-15,20-21H,10-11,13H2,1-5H3,(H,34,37)(H,35,39)/t20-,21-/m1/s1
    MOLECULAR FORMULA
    C28H32F5N3O5
    CROSS REFERENCES
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    canSAR1123870

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 585.23
    AlogP 5.17
    HBond donors 2
    HBond acceptors 8
    Atoms 73
    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 canSAR1123870.