canSAR539095
FEATURES
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NAMES
    SMILES
    CCN(CC)c1nc(NCCNC(=O)c2ccc(C(F)(F)F)cc2)c2ccccc2n1
    InChI
    InChI=1S/C22H24F3N5O/c1-3-30(4-2)21-28-18-8-6-5-7-17(18)19(29-21)26-13-14-27-20(31)15-9-11-16(12-10-15)22(23,24)25/h5-12H,3-4,13-14H2,1-2H3,(H,27,31)(H,26,28,29)
    MOLECULAR FORMULA
    C22H24F3N5O
    CROSS REFERENCES
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    canSAR539095
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight431.19
    AlogP4.34
    HBond donors2
    HBond acceptors6
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR539095.