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canSAR1835046
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NAMES
    SMILES
    O=C(O)c1ccc(NN=CC2=C(N3CCOCC3)/C(=C/c3ccccc3)CC2)cc1
    InChI
    InChI=1S/C24H25N3O3/c28-24(29)19-8-10-22(11-9-19)26-25-17-21-7-6-20(16-18-4-2-1-3-5-18)23(21)27-12-14-30-15-13-27/h1-5,8-11,16-17,26H,6-7,12-15H2,(H,28,29)/b20-16+,25-17?
    MOLECULAR FORMULA
    C24H25N3O3
    CROSS REFERENCES
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    canSAR1835046

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.19
    AlogP 4.25
    HBond donors 2
    HBond acceptors 6
    Atoms 55
    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 canSAR1835046.