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canSAR1688905
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NAMES
    SMILES
    CN=C(NCCNCc1ccc(CN(C(C)C)C(C)C)o1)C(C#N)C#N
    InChI
    InChI=1S/C19H30N6O/c1-14(2)25(15(3)4)13-18-7-6-17(26-18)12-23-8-9-24-19(22-5)16(10-20)11-21/h6-7,14-16,23H,8-9,12-13H2,1-5H3,(H,22,24)
    MOLECULAR FORMULA
    C19H30N6O
    CROSS REFERENCES
    1688905 logo

    canSAR1688905

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 358.25
    AlogP 2.27
    HBond donors 2
    HBond acceptors 7
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1688905.