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canSAR199861
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NAMES
    SMILES
    O=C1C(Nc2ccc(C(F)(F)F)cc2)=C(Cl)C(=O)c2sc(CO)cc21
    InChI
    InChI=1S/C16H9ClF3NO3S/c17-11-12(21-8-3-1-7(2-4-8)16(18,19)20)13(23)10-5-9(6-22)25-15(10)14(11)24/h1-5,21-22H,6H2
    MOLECULAR FORMULA
    C16H9ClF3NO3S
    CROSS REFERENCES
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    canSAR199861

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.99
    AlogP 4.20
    HBond donors 2
    HBond acceptors 4
    Atoms 34
    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 canSAR199861.