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canSAR1132426
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NAMES
    SMILES
    COc1ccc(Cl)cc1C(=O)Nc1ccc(C2=NN(c3ccccc3)C(c3ccc([N+](=O)[O-])cc3)C2)cc1
    InChI
    InChI=1S/C29H23ClN4O4/c1-38-28-16-11-21(30)17-25(28)29(35)31-22-12-7-19(8-13-22)26-18-27(20-9-14-24(15-10-20)34(36)37)33(32-26)23-5-3-2-4-6-23/h2-17,27H,18H2,1H3,(H,31,35)
    MOLECULAR FORMULA
    C29H23ClN4O4
    CROSS REFERENCES
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    canSAR1132426

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 526.14
    AlogP 6.86
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    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 canSAR1132426.