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canSAR1108132
FEATURES
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NAMES
    SMILES
    CC(C)(C)c1cc(NC(=O)Nc2cccc(Nc3ncnc4ccccc34)c2)n(-c2cccc([N+](=O)[O-])c2)n1
    InChI
    InChI=1S/C28H26N8O3/c1-28(2,3)24-16-25(35(34-24)20-10-7-11-21(15-20)36(38)39)33-27(37)32-19-9-6-8-18(14-19)31-26-22-12-4-5-13-23(22)29-17-30-26/h4-17H,1-3H3,(H,29,30,31)(H2,32,33,37)
    MOLECULAR FORMULA
    C28H26N8O3
    CROSS REFERENCES
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    canSAR1108132

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 522.21
    AlogP 6.41
    HBond donors 3
    HBond acceptors 11
    Atoms 65
    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 canSAR1108132.