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canSAR558590
FEATURES
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NAMES
    SMILES
    CCOC(=O)C[n+]1cc(CC)sc1N
    InChI
    InChI=1S/C9H14N2O2S/c1-3-7-5-11(9(10)14-7)6-8(12)13-4-2/h5,10H,3-4,6H2,1-2H3/p+1
    MOLECULAR FORMULA
    C9H15N2O2S+
    CROSS REFERENCES
    558590 logo

    canSAR558590

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 215.08
    AlogP 0.74
    HBond donors 2
    HBond acceptors 4
    Atoms 29
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR558590.