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canSAR993290
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NAMES
    SMILES
    CC1(C)CN(CCC#N)C(=O)[C@@H]1Oc1ccc(C#N)cc1
    InChI
    InChI=1S/C16H17N3O2/c1-16(2)11-19(9-3-8-17)15(20)14(16)21-13-6-4-12(10-18)5-7-13/h4-7,14H,3,9,11H2,1-2H3/t14-/m0/s1
    MOLECULAR FORMULA
    C16H17N3O2
    CROSS REFERENCES
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    canSAR993290

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 283.13
    AlogP 2.09
    HBond donors 0
    HBond acceptors 5
    Atoms 38
    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 canSAR993290.