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canSAR2089979
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)N2CC[C@H]3[C@@H](CC2)S(=O)(=O)CCN3C)cc1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C17H24N2O4S.C2HF3O2/c1-18-11-12-24(21,22)16-8-10-19(9-7-15(16)18)17(20)13-3-5-14(23-2)6-4-13;3-2(4,5)1(6)7/h3-6,15-16H,7-12H2,1-2H3;(H,6,7)/t15-,16+;/m0./s1
    MOLECULAR FORMULA
    C19H25F3N2O6S
    CROSS REFERENCES
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    canSAR2089979

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 466.14
    AlogP 1.66
    HBond donors 1
    HBond acceptors 8
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2089979.