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canSAR1432189
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NAMES
    SMILES
    OC1(C(F)(F)F)CC(c2ccccc2)=NN1C(=S)c1ccccc1
    InChI
    InChI=1S/C17H13F3N2OS/c18-17(19,20)16(23)11-14(12-7-3-1-4-8-12)21-22(16)15(24)13-9-5-2-6-10-13/h1-10,23H,11H2
    MOLECULAR FORMULA
    C17H13F3N2OS
    CROSS REFERENCES
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    canSAR1432189

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 350.07
    AlogP 3.72
    HBond donors 1
    HBond acceptors 3
    Atoms 37
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1432189.