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canSAR1101544
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NAMES
    SMILES
    O=S(=O)(Nc1nncs1)c1cc(Cl)c(Oc2ccc(Cl)cc2C2CCNCC2)cc1F
    InChI
    InChI=1S/C19H17Cl2FN4O3S2/c20-12-1-2-16(13(7-12)11-3-5-23-6-4-11)29-17-9-15(22)18(8-14(17)21)31(27,28)26-19-25-24-10-30-19/h1-2,7-11,23H,3-6H2,(H,25,26)
    MOLECULAR FORMULA
    C19H17Cl2FN4O3S2
    CROSS REFERENCES
    1101544 logo

    canSAR1101544

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.01
    AlogP 5.04
    HBond donors 2
    HBond acceptors 7
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1101544.