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canSAR1017937
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NAMES
    SMILES
    O=C(N[C@H]1CC[C@H]2CN(Cc3cccc(C(F)(F)F)c3)C[C@@H]12)C1CCCC1
    InChI
    InChI=1S/C21H27F3N2O/c22-21(23,24)17-7-3-4-14(10-17)11-26-12-16-8-9-19(18(16)13-26)25-20(27)15-5-1-2-6-15/h3-4,7,10,15-16,18-19H,1-2,5-6,8-9,11-13H2,(H,25,27)/t16-,18+,19-/m0/s1
    MOLECULAR FORMULA
    C21H27F3N2O
    CROSS REFERENCES
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    canSAR1017937

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.21
    AlogP 4.22
    HBond donors 1
    HBond acceptors 3
    Atoms 54
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1017937.