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canSAR1621305
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NAMES
    SMILES
    CCN1CCN(C2=C(Nc3ccccc3)C(=O)c3ccccc3C2=O)CC1
    InChI
    InChI=1S/C22H23N3O2/c1-2-24-12-14-25(15-13-24)20-19(23-16-8-4-3-5-9-16)21(26)17-10-6-7-11-18(17)22(20)27/h3-11,23H,2,12-15H2,1H3
    MOLECULAR FORMULA
    C22H23N3O2
    CROSS REFERENCES
    1621305 logo

    canSAR1621305

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.18
    AlogP 3.03
    HBond donors 1
    HBond acceptors 5
    Atoms 50
    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 canSAR1621305.