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canSAR1833621
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NAMES
    SMILES
    C[C@@H](O)CN1CCN(c2ccc(Nc3ncc4cc(C(=O)N(C)C)n(C5CCCC5)c4n3)nc2)CC1
    InChI
    InChI=1S/C26H36N8O2/c1-18(35)17-32-10-12-33(13-11-32)21-8-9-23(27-16-21)29-26-28-15-19-14-22(25(36)31(2)3)34(24(19)30-26)20-6-4-5-7-20/h8-9,14-16,18,20,35H,4-7,10-13,17H2,1-3H3,(H,27,28,29,30)/t18-/m1/s1
    MOLECULAR FORMULA
    C26H36N8O2
    CROSS REFERENCES
    1833621 logo

    canSAR1833621

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 492.30
    AlogP 2.89
    HBond donors 2
    HBond acceptors 10
    Atoms 72
    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 canSAR1833621.