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canSAR784770
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NAMES
    SMILES
    C[C@@H]1CN(CC2(c3ccncc3)CCC2)CCN1S(=O)(=O)c1ccc(C(C)(O)C(F)(F)F)cc1
    InChI
    InChI=1S/C24H30F3N3O3S/c1-18-16-29(17-23(10-3-11-23)20-8-12-28-13-9-20)14-15-30(18)34(32,33)21-6-4-19(5-7-21)22(2,31)24(25,26)27/h4-9,12-13,18,31H,3,10-11,14-17H2,1-2H3/t18-,22?/m1/s1
    MOLECULAR FORMULA
    C24H30F3N3O3S
    CROSS REFERENCES
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    canSAR784770

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 497.20
    AlogP 3.67
    HBond donors 1
    HBond acceptors 6
    Atoms 64
    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 canSAR784770.