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canSAR1651562
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NAMES
    SMILES
    COc1cc(OC(F)(F)F)ccc1-c1cccc(C(CC(=O)O)c2nccs2)c1
    InChI
    InChI=1S/C20H16F3NO4S/c1-27-17-10-14(28-20(21,22)23)5-6-15(17)12-3-2-4-13(9-12)16(11-18(25)26)19-24-7-8-29-19/h2-10,16H,11H2,1H3,(H,25,26)
    MOLECULAR FORMULA
    C20H16F3NO4S
    CROSS REFERENCES
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    canSAR1651562

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.08
    AlogP 5.32
    HBond donors 1
    HBond acceptors 5
    Atoms 45
    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 canSAR1651562.