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canSAR1975497
FEATURES
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NAMES
    SMILES
    O=C1N(Cc2cccnc2)C[C@@H]2C[C@@H](c3ccccc3C(F)(F)F)N3CCC[C@@]123
    InChI
    InChI=1S/C22H22F3N3O/c23-22(24,25)18-7-2-1-6-17(18)19-11-16-14-27(13-15-5-3-9-26-12-15)20(29)21(16)8-4-10-28(19)21/h1-3,5-7,9,12,16,19H,4,8,10-11,13-14H2/t16-,19-,21-/m0/s1
    MOLECULAR FORMULA
    C22H22F3N3O
    CROSS REFERENCES
    1975497 logo

    canSAR1975497

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.17
    AlogP 4.04
    HBond donors 0
    HBond acceptors 4
    Atoms 51
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1975497.