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canSAR161831
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NAMES
    SMILES
    CCOC(=O)N1CCC(c2ccccc2)(c2nccn2Cc2ccc(C(=O)OC)cc2)CC1
    InChI
    InChI=1S/C26H29N3O4/c1-3-33-25(31)28-16-13-26(14-17-28,22-7-5-4-6-8-22)24-27-15-18-29(24)19-20-9-11-21(12-10-20)23(30)32-2/h4-12,15,18H,3,13-14,16-17,19H2,1-2H3
    MOLECULAR FORMULA
    C26H29N3O4
    CROSS REFERENCES
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    canSAR161831

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.22
    AlogP 4.26
    HBond donors 0
    HBond acceptors 7
    Atoms 62
    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 canSAR161831.