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canSAR115085
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NAMES
    SMILES
    CCC(O)CN1CCC(c2cc(-c3ccncc3)c(-c3ccc(F)cc3)[nH]2)CC1
    InChI
    InChI=1S/C24H28FN3O/c1-2-21(29)16-28-13-9-18(10-14-28)23-15-22(17-7-11-26-12-8-17)24(27-23)19-3-5-20(25)6-4-19/h3-8,11-12,15,18,21,27,29H,2,9-10,13-14,16H2,1H3
    MOLECULAR FORMULA
    C24H28FN3O
    CROSS REFERENCES
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    canSAR115085

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.22
    AlogP 4.83
    HBond donors 2
    HBond acceptors 4
    Atoms 57
    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 canSAR115085.