canSAR1706436
FEATURES
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NAMES
    SMILES
    COc1cc(NC(=O)c2nccn2C)cc(C(=O)Nc2cccc(C(F)(F)F)c2)c1
    InChI
    InChI=1S/C20H17F3N4O3/c1-27-7-6-24-17(27)19(29)26-15-8-12(9-16(11-15)30-2)18(28)25-14-5-3-4-13(10-14)20(21,22)23/h3-11H,1-2H3,(H,25,28)(H,26,29)
    MOLECULAR FORMULA
    C20H17F3N4O3
    CROSS REFERENCES
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    canSAR1706436
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight418.13
    AlogP3.95
    HBond donors2
    HBond acceptors7
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1706436.