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canSAR1498180
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NAMES
    SMILES
    O=C(Oc1ccc2c(=O)c(Oc3ccccc3Br)c(C(F)(F)F)oc2c1)c1cccs1
    InChI
    InChI=1S/C21H10BrF3O5S/c22-13-4-1-2-5-14(13)29-18-17(26)12-8-7-11(28-20(27)16-6-3-9-31-16)10-15(12)30-19(18)21(23,24)25/h1-10H
    MOLECULAR FORMULA
    C21H10BrF3O5S
    CROSS REFERENCES
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    canSAR1498180

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.94
    AlogP 6.65
    HBond donors 0
    HBond acceptors 5
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1498180.