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canSAR1128615
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NAMES
    SMILES
    CC(=N)NCc1cccc2c(-c3ccc(C(C)(C)C)cc3)ncnc12
    InChI
    InChI=1S/C21H24N4/c1-14(22)23-12-16-6-5-7-18-19(24-13-25-20(16)18)15-8-10-17(11-9-15)21(2,3)4/h5-11,13H,12H2,1-4H3,(H2,22,23)
    MOLECULAR FORMULA
    C21H24N4
    CROSS REFERENCES
    1128615 logo

    canSAR1128615

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 332.20
    AlogP 4.68
    HBond donors 2
    HBond acceptors 4
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1128615.