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canSAR1592921
FEATURES
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NAMES
    SMILES
    CCCCCC(=O)N1CC2(CC(c3cccc(NC(=O)c4ccccc4)c3)=NO2)C[C@@H]1C(N)=O
    InChI
    InChI=1S/C26H30N4O4/c1-2-3-5-13-23(31)30-17-26(16-22(30)24(27)32)15-21(29-34-26)19-11-8-12-20(14-19)28-25(33)18-9-6-4-7-10-18/h4,6-12,14,22H,2-3,5,13,15-17H2,1H3,(H2,27,32)(H,28,33)/t22-,26?/m1/s1
    MOLECULAR FORMULA
    C26H30N4O4
    CROSS REFERENCES
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    canSAR1592921

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.23
    AlogP 3.47
    HBond donors 3
    HBond acceptors 8
    Atoms 64
    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 canSAR1592921.