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canSAR1430360
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NAMES
    SMILES
    O=C(NN=Cc1ccc(O)c(O)c1)/C(O)=C\C1=NC2(CCCC2)Cc2ccccc21
    InChI
    InChI=1S/C23H23N3O4/c27-19-8-7-15(11-20(19)28)14-24-26-22(30)21(29)12-18-17-6-2-1-5-16(17)13-23(25-18)9-3-4-10-23/h1-2,5-8,11-12,14,27-29H,3-4,9-10,13H2,(H,26,30)/b21-12+,24-14?
    MOLECULAR FORMULA
    C23H23N3O4
    CROSS REFERENCES
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    canSAR1430360

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.17
    AlogP 3.35
    HBond donors 4
    HBond acceptors 7
    Atoms 53
    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 canSAR1430360.