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canSAR655900
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NAMES
    SMILES
    COC(=O)NCCc1n[nH]c2c1C(=O)C=C(C)C2=O
    InChI
    InChI=1S/C12H13N3O4/c1-6-5-8(16)9-7(3-4-13-12(18)19-2)14-15-10(9)11(6)17/h5H,3-4H2,1-2H3,(H,13,18)(H,14,15)
    MOLECULAR FORMULA
    C12H13N3O4
    CROSS REFERENCES
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    canSAR655900

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 263.09
    AlogP 0.63
    HBond donors 2
    HBond acceptors 7
    Atoms 32
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR655900.