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canSAR344626
FEATURES
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NAMES
    SMILES
    C[C@@H](NC(=O)CC(C)(C)N)C(=O)NCc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
    InChI
    InChI=1S/C22H27N7O2/c1-14(25-19(30)12-22(2,3)23)21(31)24-13-15-8-10-16(11-9-15)17-6-4-5-7-18(17)20-26-28-29-27-20/h4-11,14H,12-13,23H2,1-3H3,(H,24,31)(H,25,30)(H,26,27,28,29)/t14-/m1/s1
    MOLECULAR FORMULA
    C22H27N7O2
    CROSS REFERENCES
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    canSAR344626

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.22
    AlogP 1.78
    HBond donors 5
    HBond acceptors 9
    Atoms 58
    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 canSAR344626.