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canSAR1108575
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NAMES
    SMILES
    O=C1C(Sc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)=C(N2CCCC2)C(=O)c2ccccc21
    InChI
    InChI=1S/C20H12Cl5NO2S/c21-11-12(22)14(24)19(15(25)13(11)23)29-20-16(26-7-3-4-8-26)17(27)9-5-1-2-6-10(9)18(20)28/h1-2,5-6H,3-4,7-8H2
    MOLECULAR FORMULA
    C20H12Cl5NO2S
    CROSS REFERENCES
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    canSAR1108575

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.90
    AlogP 7.43
    HBond donors 0
    HBond acceptors 3
    Atoms 41
    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 canSAR1108575.