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canSAR1201180
FEATURES
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NAMES
    SMILES
    CCN(CC)C(=O)/C=C/c1c2ccccc2cc2ccccc12
    InChI
    InChI=1S/C21H21NO/c1-3-22(4-2)21(23)14-13-20-18-11-7-5-9-16(18)15-17-10-6-8-12-19(17)20/h5-15H,3-4H2,1-2H3/b14-13+
    MOLECULAR FORMULA
    C21H21NO
    CROSS REFERENCES
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    canSAR1201180

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 303.16
    AlogP 4.87
    HBond donors 0
    HBond acceptors 2
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1201180.