canSAR731903
FEATURES
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NAMES
    SMILES
    Nc1cccc(CCNc2nc(Nc3ccc(CCNc4nc(NCCO)nc(Nc5cccc(N)c5)n4)cc3)nc(Nc3cccc(N)c3)n2)c1
    InChI
    InChI=1S/C36H41N15O/c37-25-5-1-4-24(20-25)15-17-41-32-48-34(51-36(49-32)45-30-9-3-7-27(39)22-30)43-28-12-10-23(11-13-28)14-16-40-31-46-33(42-18-19-52)50-35(47-31)44-29-8-2-6-26(38)21-29/h1-13,20-22,52H,14-19,37-39H2,(H3,40,42,44,46,47,50)(H3,41,43,45,48,49,51)
    MOLECULAR FORMULA
    C36H41N15O
    CROSS REFERENCES
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    canSAR731903
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight699.36
    AlogP4.75
    HBond donors13
    HBond acceptors16
    Atoms93
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR731903.