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canSAR744657
FEATURES
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NAMES
    SMILES
    CC(C)Cn1c(=O)n(CN(C(C)C)C(C)C)c(=O)c2[nH]c(Cc3ccc(Br)cc3)nc21.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C23H32BrN5O2.C2HF3O2/c1-14(2)12-27-21-20(25-19(26-21)11-17-7-9-18(24)10-8-17)22(30)29(23(27)31)13-28(15(3)4)16(5)6;3-2(4,5)1(6)7/h7-10,14-16H,11-13H2,1-6H3,(H,25,26);(H,6,7)
    MOLECULAR FORMULA
    C25H33BrF3N5O4
    CROSS REFERENCES
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    canSAR744657

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 603.17
    AlogP 4.61
    HBond donors 2
    HBond acceptors 9
    Atoms 71
    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 canSAR744657.