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canSAR2015534
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NAMES
    SMILES
    CC1(C)c2cc(C(=O)N3CCN(C(C)(C)C)CC3)ccc2C(=O)c2c1[nH]c1cc(C#N)ccc21
    InChI
    InChI=1S/C28H30N4O2/c1-27(2,3)32-12-10-31(11-13-32)26(34)18-7-9-19-21(15-18)28(4,5)25-23(24(19)33)20-8-6-17(16-29)14-22(20)30-25/h6-9,14-15,30H,10-13H2,1-5H3
    MOLECULAR FORMULA
    C28H30N4O2
    CROSS REFERENCES
    2015534 logo

    canSAR2015534

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.24
    AlogP 4.47
    HBond donors 1
    HBond acceptors 6
    Atoms 64
    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 canSAR2015534.