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canSAR747861
FEATURES
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NAMES
    SMILES
    CCOc1ccccc1-n1c(=O)c2[nH]c(Cc3ccc(Br)cc3)nc2n(CC(C)C)c1=O.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C24H25BrN4O3.C2HF3O2/c1-4-32-19-8-6-5-7-18(19)29-23(30)21-22(28(24(29)31)14-15(2)3)27-20(26-21)13-16-9-11-17(25)12-10-16;3-2(4,5)1(6)7/h5-12,15H,4,13-14H2,1-3H3,(H,26,27);(H,6,7)
    MOLECULAR FORMULA
    C26H26BrF3N4O5
    CROSS REFERENCES
    747861 logo

    canSAR747861

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 610.10
    AlogP 4.92
    HBond donors 2
    HBond acceptors 9
    Atoms 65
    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 canSAR747861.