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canSAR1504647
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NAMES
    SMILES
    O=C(NCCn1cc(SCc2cccc(F)c2)c2ccccc21)c1cccc(C(F)(F)F)c1
    InChI
    InChI=1S/C25H20F4N2OS/c26-20-8-3-5-17(13-20)16-33-23-15-31(22-10-2-1-9-21(22)23)12-11-30-24(32)18-6-4-7-19(14-18)25(27,28)29/h1-10,13-15H,11-12,16H2,(H,30,32)
    MOLECULAR FORMULA
    C25H20F4N2OS
    CROSS REFERENCES
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    canSAR1504647

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 472.12
    AlogP 6.52
    HBond donors 1
    HBond acceptors 3
    Atoms 53
    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 canSAR1504647.