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canSAR1528229
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NAMES
    SMILES
    O=C(CN1CCN(Cc2ccccc2F)CC1)NC1CC(F)c2c(Br)sc(Br)c21
    InChI
    InChI=1S/C20H21Br2F2N3OS/c21-19-17-14(24)9-15(18(17)20(22)29-19)25-16(28)11-27-7-5-26(6-8-27)10-12-3-1-2-4-13(12)23/h1-4,14-15H,5-11H2,(H,25,28)
    MOLECULAR FORMULA
    C20H21Br2F2N3OS
    CROSS REFERENCES
    1528229 logo

    canSAR1528229

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 546.97
    AlogP 4.80
    HBond donors 1
    HBond acceptors 4
    Atoms 50
    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 canSAR1528229.