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canSAR1716552
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NAMES
    SMILES
    CC1C/C(=N\NC(=S)NC(C)C)CC(C)(C)C1
    InChI
    InChI=1S/C13H25N3S/c1-9(2)14-12(17)16-15-11-6-10(3)7-13(4,5)8-11/h9-10H,6-8H2,1-5H3,(H2,14,16,17)/b15-11+
    MOLECULAR FORMULA
    C13H25N3S
    CROSS REFERENCES
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    canSAR1716552

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 255.18
    AlogP 3.06
    HBond donors 2
    HBond acceptors 3
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1716552.