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canSAR649905
FEATURES
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NAMES
    SMILES
    CCN(CC)c1ccc(/C=C2/C(=O)Nc3ccc(N)cc32)cc1
    InChI
    InChI=1S/C19H21N3O/c1-3-22(4-2)15-8-5-13(6-9-15)11-17-16-12-14(20)7-10-18(16)21-19(17)23/h5-12H,3-4,20H2,1-2H3,(H,21,23)/b17-11+
    MOLECULAR FORMULA
    C19H21N3O
    CROSS REFERENCES
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    canSAR649905

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 307.17
    AlogP 3.61
    HBond donors 3
    HBond acceptors 4
    Atoms 44
    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 canSAR649905.