canSAR2097702
FEATURES
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NAMES
    SMILES
    CCN(CC)[c+]1sc2c(s1)C(c1ccc(F)cc1)Oc1ccc(Cl)cc1-2.F[B-](F)(F)F
    InChI
    InChI=1S/C20H18ClFNOS2.BF4/c1-3-23(4-2)20-25-18-15-11-13(21)7-10-16(15)24-17(19(18)26-20)12-5-8-14(22)9-6-12;2-1(3,4)5/h5-11,17H,3-4H2,1-2H3;/q+1;-1
    MOLECULAR FORMULA
    C20H18BClF5NOS2
    CROSS REFERENCES
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    canSAR2097702
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight493.05
    AlogP8.18
    HBond donors0
    HBond acceptors2
    Atoms49
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2097702.