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canSAR651843
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NAMES
    SMILES
    O=S(=O)(C1CC1)N1CCN(C[C@@H]2CC[C@@H](c3ccc(Cl)cc3Cl)N(c3ccc(Cl)cc3)C2)CC1
    InChI
    InChI=1S/C25H30Cl3N3O2S/c26-19-2-5-21(6-3-19)31-17-18(1-10-25(31)23-9-4-20(27)15-24(23)28)16-29-11-13-30(14-12-29)34(32,33)22-7-8-22/h2-6,9,15,18,22,25H,1,7-8,10-14,16-17H2/t18-,25-/m0/s1
    MOLECULAR FORMULA
    C25H30Cl3N3O2S
    CROSS REFERENCES
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    canSAR651843

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 541.11
    AlogP 5.71
    HBond donors 0
    HBond acceptors 5
    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 canSAR651843.