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canSAR1061577
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NAMES
    SMILES
    CC(C)C[C@H](C(N)=O)N(Cc1ccc(CN(C)C)cc1)S(=O)(=O)c1ccc(Cl)cc1
    InChI
    InChI=1S/C22H30ClN3O3S/c1-16(2)13-21(22(24)27)26(30(28,29)20-11-9-19(23)10-12-20)15-18-7-5-17(6-8-18)14-25(3)4/h5-12,16,21H,13-15H2,1-4H3,(H2,24,27)/t21-/m1/s1
    MOLECULAR FORMULA
    C22H30ClN3O3S
    CROSS REFERENCES
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    canSAR1061577

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.17
    AlogP 3.49
    HBond donors 2
    HBond acceptors 6
    Atoms 60
    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 canSAR1061577.