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canSAR161975
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NAMES
    SMILES
    COc1cc2c(cc1OC)CC(=O)N(CCCN(C)CCc1ccc(N)cc1)CC2
    InChI
    InChI=1S/C24H33N3O3/c1-26(13-9-18-5-7-21(25)8-6-18)11-4-12-27-14-10-19-15-22(29-2)23(30-3)16-20(19)17-24(27)28/h5-8,15-16H,4,9-14,17,25H2,1-3H3
    MOLECULAR FORMULA
    C24H33N3O3
    CROSS REFERENCES
    161975 logo

    canSAR161975

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.25
    AlogP 2.78
    HBond donors 2
    HBond acceptors 6
    Atoms 63
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR161975.