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canSAR2091298
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NAMES
    SMILES
    N[C@H]1CCCN(c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cccc3F)n2)C1
    InChI
    InChI=1S/C22H20F3N5O/c23-14-4-1-5-15(24)20(14)21-16(25)6-7-17(28-21)22(31)29-18-11-27-9-8-19(18)30-10-2-3-13(26)12-30/h1,4-9,11,13H,2-3,10,12,26H2,(H,29,31)/t13-/m0/s1
    MOLECULAR FORMULA
    C22H20F3N5O
    CROSS REFERENCES
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    canSAR2091298

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.16
    AlogP 3.74
    HBond donors 3
    HBond acceptors 6
    Atoms 51
    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 canSAR2091298.