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canSAR1767816
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NAMES
    SMILES
    COc1ccc(Cl)cc1-c1cc(Cl)cc(C(CC(=O)O)c2ncc(C)s2)c1
    InChI
    InChI=1S/C20H17Cl2NO3S/c1-11-10-23-20(27-11)17(9-19(24)25)13-5-12(6-15(22)7-13)16-8-14(21)3-4-18(16)26-2/h3-8,10,17H,9H2,1-2H3,(H,24,25)
    MOLECULAR FORMULA
    C20H17Cl2NO3S
    CROSS REFERENCES
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    canSAR1767816

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.03
    AlogP 6.04
    HBond donors 1
    HBond acceptors 4
    Atoms 44
    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 canSAR1767816.