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canSAR1515827
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NAMES
    SMILES
    O=S(=O)(Nc1ncc(F)s1)c1ccc2c(-c3ccc(C(F)(F)F)cc3C3CCNCC3)cccc2c1
    InChI
    InChI=1S/C25H21F4N3O2S2/c26-23-14-31-24(35-23)32-36(33,34)18-5-7-19-16(12-18)2-1-3-20(19)21-6-4-17(25(27,28)29)13-22(21)15-8-10-30-11-9-15/h1-7,12-15,30H,8-11H2,(H,31,32)
    MOLECULAR FORMULA
    C25H21F4N3O2S2
    CROSS REFERENCES
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    canSAR1515827

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 535.10
    AlogP 6.39
    HBond donors 2
    HBond acceptors 5
    Atoms 57
    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 canSAR1515827.