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canSAR1018083
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NAMES
    SMILES
    CCOC(=O)[C@H]1C[C@@H]2COc3ccc(/N=N/c4ccccc4)cc3[C@@H]2N1C
    InChI
    InChI=1S/C21H23N3O3/c1-3-26-21(25)18-11-14-13-27-19-10-9-16(12-17(19)20(14)24(18)2)23-22-15-7-5-4-6-8-15/h4-10,12,14,18,20H,3,11,13H2,1-2H3/b23-22+/t14-,18-,20-/m1/s1
    MOLECULAR FORMULA
    C21H23N3O3
    CROSS REFERENCES
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    canSAR1018083

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.17
    AlogP 4.42
    HBond donors 0
    HBond acceptors 6
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1018083.