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canSAR195564
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NAMES
    SMILES
    CC1(C)CCC(C)(C)c2cc(CNc3ccc(C(=O)O)cc3)ccc21
    InChI
    InChI=1S/C22H27NO2/c1-21(2)11-12-22(3,4)19-13-15(5-10-18(19)21)14-23-17-8-6-16(7-9-17)20(24)25/h5-10,13,23H,11-12,14H2,1-4H3,(H,24,25)
    MOLECULAR FORMULA
    C22H27NO2
    CROSS REFERENCES
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    canSAR195564

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 337.20
    AlogP 5.35
    HBond donors 2
    HBond acceptors 3
    Atoms 52
    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 canSAR195564.