canSAR738881
FEATURES
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NAMES
    SMILES
    CC1(C)CNC(c2cccc(-c3ccc(-c4cccc(C5=NC(C)(C)CN5)c4)o3)c2)=N1
    InChI
    InChI=1S/C26H28N4O/c1-25(2)15-27-23(29-25)19-9-5-7-17(13-19)21-11-12-22(31-21)18-8-6-10-20(14-18)24-28-16-26(3,4)30-24/h5-14H,15-16H2,1-4H3,(H,27,29)(H,28,30)
    MOLECULAR FORMULA
    C26H28N4O
    CROSS REFERENCES
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    canSAR738881
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight412.23
    AlogP4.87
    HBond donors2
    HBond acceptors5
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR738881.