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canSAR346218
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NAMES
    SMILES
    COC(=O)Nc1nc(CCI)cs1
    InChI
    InChI=1S/C7H9IN2O2S/c1-12-7(11)10-6-9-5(2-3-8)4-13-6/h4H,2-3H2,1H3,(H,9,10,11)
    MOLECULAR FORMULA
    C7H9IN2O2S
    CROSS REFERENCES
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    canSAR346218

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 311.94
    AlogP 2.30
    HBond donors 1
    HBond acceptors 4
    Atoms 22
    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 canSAR346218.