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canSAR1089791
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NAMES
    SMILES
    C[C@H]1CN(Cc2ccc(N(C)C(=O)c3ccc(-c4cccc(C#N)c4)cn3)cc2)CCN1
    InChI
    InChI=1S/C26H27N5O/c1-19-17-31(13-12-28-19)18-20-6-9-24(10-7-20)30(2)26(32)25-11-8-23(16-29-25)22-5-3-4-21(14-22)15-27/h3-11,14,16,19,28H,12-13,17-18H2,1-2H3/t19-/m0/s1
    MOLECULAR FORMULA
    C26H27N5O
    CROSS REFERENCES
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    canSAR1089791

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.22
    AlogP 3.69
    HBond donors 1
    HBond acceptors 6
    Atoms 59
    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 canSAR1089791.