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canSAR2016123
FEATURES
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NAMES
    SMILES
    COC(=O)c1cccc([N+](=O)[O-])c1CS(=O)(=O)c1ccc(C)cc1
    InChI
    InChI=1S/C16H15NO6S/c1-11-6-8-12(9-7-11)24(21,22)10-14-13(16(18)23-2)4-3-5-15(14)17(19)20/h3-9H,10H2,1-2H3
    MOLECULAR FORMULA
    C16H15NO6S
    CROSS REFERENCES
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    canSAR2016123

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 349.06
    AlogP 2.66
    HBond donors 0
    HBond acceptors 7
    Atoms 39
    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 canSAR2016123.