canSAR2096135
FEATURES
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NAMES
    SMILES
    FC(F)(F)Oc1cccc(Nc2nnnc3ccc(N4CCC(N5CCCC5)CC4)nc23)c1
    InChI
    InChI=1S/C22H24F3N7O/c23-22(24,25)33-17-5-3-4-15(14-17)26-21-20-18(28-30-29-21)6-7-19(27-20)32-12-8-16(9-13-32)31-10-1-2-11-31/h3-7,14,16H,1-2,8-13H2,(H,26,28,29)
    MOLECULAR FORMULA
    C22H24F3N7O
    CROSS REFERENCES
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    canSAR2096135
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight459.20
    AlogP4.13
    HBond donors1
    HBond acceptors8
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096135.