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canSAR504649
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NAMES
    SMILES
    CN(c1c(NCc2ccc(C#N)cc2)c(=O)c1=O)C(C)(C)C
    InChI
    InChI=1S/C17H19N3O2/c1-17(2,3)20(4)14-13(15(21)16(14)22)19-10-12-7-5-11(9-18)6-8-12/h5-8,19H,10H2,1-4H3
    MOLECULAR FORMULA
    C17H19N3O2
    CROSS REFERENCES
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    canSAR504649

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.15
    AlogP 2.00
    HBond donors 1
    HBond acceptors 5
    Atoms 41
    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 canSAR504649.