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canSAR1589949
FEATURES
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NAMES
    SMILES
    COc1ccccc1N1CCN(CC(O)c2c(C)[nH]c3ccccc23)CC1
    InChI
    InChI=1S/C22H27N3O2/c1-16-22(17-7-3-4-8-18(17)23-16)20(26)15-24-11-13-25(14-12-24)19-9-5-6-10-21(19)27-2/h3-10,20,23,26H,11-15H2,1-2H3
    MOLECULAR FORMULA
    C22H27N3O2
    CROSS REFERENCES
    1589949 logo

    canSAR1589949

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.21
    AlogP 3.34
    HBond donors 2
    HBond acceptors 5
    Atoms 54
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1589949.