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canSAR467030
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NAMES
    SMILES
    OC(CN1CCN(Cc2ccc(Br)cc2F)CC1)(Cn1cncn1)c1ccc(F)cc1F
    InChI
    InChI=1S/C22H23BrF3N5O/c23-17-2-1-16(20(25)9-17)11-29-5-7-30(8-6-29)12-22(32,13-31-15-27-14-28-31)19-4-3-18(24)10-21(19)26/h1-4,9-10,14-15,32H,5-8,11-13H2
    MOLECULAR FORMULA
    C22H23BrF3N5O
    CROSS REFERENCES
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    canSAR467030

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.10
    AlogP 3.16
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    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 canSAR467030.