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canSAR344806
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NAMES
    SMILES
    COc1cccc2c1N1CCN(CCCCNC(=O)c3ccc4ccccc4c3)CC1CC2
    InChI
    InChI=1S/C28H33N3O2/c1-33-26-10-6-9-22-13-14-25-20-30(17-18-31(25)27(22)26)16-5-4-15-29-28(32)24-12-11-21-7-2-3-8-23(21)19-24/h2-3,6-12,19,25H,4-5,13-18,20H2,1H3,(H,29,32)
    MOLECULAR FORMULA
    C28H33N3O2
    CROSS REFERENCES
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    canSAR344806

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.26
    AlogP 4.50
    HBond donors 1
    HBond acceptors 5
    Atoms 66
    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 canSAR344806.