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canSAR2094168
FEATURES
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NAMES
    SMILES
    CCCC[C@H](CN(O)C=O)C(=O)N1CC2(CC2)C[C@H]1c1nc(-c2cccnc2)no1
    InChI
    InChI=1S/C21H27N5O4/c1-2-3-5-16(12-25(29)14-27)20(28)26-13-21(7-8-21)10-17(26)19-23-18(24-30-19)15-6-4-9-22-11-15/h4,6,9,11,14,16-17,29H,2-3,5,7-8,10,12-13H2,1H3/t16-,17+/m1/s1
    MOLECULAR FORMULA
    C21H27N5O4
    CROSS REFERENCES
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    canSAR2094168

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.21
    AlogP 2.84
    HBond donors 1
    HBond acceptors 9
    Atoms 57
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2094168.