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canSAR64779
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NAMES
    SMILES
    COc1ccc(Nc2ncnc3cc(OC)c(OCCCSc4nc5ccccc5o4)cc23)cc1
    InChI
    InChI=1S/C26H24N4O4S/c1-31-18-10-8-17(9-11-18)29-25-19-14-24(23(32-2)15-21(19)27-16-28-25)33-12-5-13-35-26-30-20-6-3-4-7-22(20)34-26/h3-4,6-11,14-16H,5,12-13H2,1-2H3,(H,27,28,29)
    MOLECULAR FORMULA
    C26H24N4O4S
    CROSS REFERENCES
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    canSAR64779

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.15
    AlogP 6.09
    HBond donors 1
    HBond acceptors 8
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR64779.