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canSAR176910
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NAMES
    SMILES
    CC1=NN(c2ccccc2)C(=O)/C1=C(/c1ccc(Cl)cc1)N1CCN(C)CC1
    InChI
    InChI=1S/C22H23ClN4O/c1-16-20(22(28)27(24-16)19-6-4-3-5-7-19)21(17-8-10-18(23)11-9-17)26-14-12-25(2)13-15-26/h3-11H,12-15H2,1-2H3/b21-20-
    MOLECULAR FORMULA
    C22H23ClN4O
    CROSS REFERENCES
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    canSAR176910

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.16
    AlogP 3.72
    HBond donors 0
    HBond acceptors 5
    Atoms 51
    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 canSAR176910.