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canSAR548523
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NAMES
    SMILES
    CC(N[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)c1cccc2ccccc12.Cl
    InChI
    InChI=1S/C25H27F3N2O3S.ClH/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)29-23-11-4-5-12-24(23)30-34(31,32)20-15-13-19(14-16-20)33-25(26,27)28;/h2-3,6-10,13-17,23-24,29-30H,4-5,11-12H2,1H3;1H/t17?,23-,24-;/m1./s1
    MOLECULAR FORMULA
    C25H28ClF3N2O3S
    CROSS REFERENCES
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    canSAR548523

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 528.15
    AlogP 6.10
    HBond donors 2
    HBond acceptors 5
    Atoms 63
    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 canSAR548523.