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canSAR161582
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NAMES
    SMILES
    O=C(CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(F)cc3)[nH]2)CC1)N1CCC1
    InChI
    InChI=1S/C25H27FN4O/c26-21-4-2-20(3-5-21)25-22(18-6-10-27-11-7-18)16-23(28-25)19-8-14-29(15-9-19)17-24(31)30-12-1-13-30/h2-7,10-11,16,19,28H,1,8-9,12-15,17H2
    MOLECULAR FORMULA
    C25H27FN4O
    CROSS REFERENCES
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    canSAR161582

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.22
    AlogP 4.29
    HBond donors 1
    HBond acceptors 5
    Atoms 58
    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 canSAR161582.