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canSAR39256
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NAMES
    SMILES
    C[C@@H]1CC[C@@H](C#N)N1C(=O)[C@@H](N)C1CCCC1
    InChI
    InChI=1S/C13H21N3O/c1-9-6-7-11(8-14)16(9)13(17)12(15)10-4-2-3-5-10/h9-12H,2-7,15H2,1H3/t9-,11+,12+/m1/s1
    MOLECULAR FORMULA
    C13H21N3O
    CROSS REFERENCES
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    canSAR39256

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 235.17
    AlogP 1.41
    HBond donors 2
    HBond acceptors 4
    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 canSAR39256.