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canSAR782606
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NAMES
    SMILES
    O=C1CSC(c2c(Cl)cccc2Cl)N1C1CCC1[N+](=O)[O-]
    InChI
    InChI=1S/C13H12Cl2N2O3S/c14-7-2-1-3-8(15)12(7)13-16(11(18)6-21-13)9-4-5-10(9)17(19)20/h1-3,9-10,13H,4-6H2
    MOLECULAR FORMULA
    C13H12Cl2N2O3S
    CROSS REFERENCES
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    canSAR782606

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 345.99
    AlogP 3.38
    HBond donors 0
    HBond acceptors 5
    Atoms 33
    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 canSAR782606.