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canSAR1109833
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NAMES
    SMILES
    COc1ccc(-c2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)cc2)cn1
    InChI
    InChI=1S/C27H29N5O2/c1-18-6-13-22(14-7-18)32-24(16-23(31-32)27(2,3)4)30-26(33)29-21-11-8-19(9-12-21)20-10-15-25(34-5)28-17-20/h6-17H,1-5H3,(H2,29,30,33)
    MOLECULAR FORMULA
    C27H29N5O2
    CROSS REFERENCES
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    canSAR1109833

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.23
    AlogP 6.19
    HBond donors 2
    HBond acceptors 7
    Atoms 63
    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 canSAR1109833.