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canSAR1859731
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NAMES
    SMILES
    COc1ccc(NC(=S)N(Cc2ccc(Cl)cc2)Cc2ccc(C(=O)O)cc2)cc1Cl
    InChI
    InChI=1S/C23H20Cl2N2O3S/c1-30-21-11-10-19(12-20(21)25)26-23(31)27(14-16-4-8-18(24)9-5-16)13-15-2-6-17(7-3-15)22(28)29/h2-12H,13-14H2,1H3,(H,26,31)(H,28,29)
    MOLECULAR FORMULA
    C23H20Cl2N2O3S
    CROSS REFERENCES
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    canSAR1859731

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.06
    AlogP 6.10
    HBond donors 2
    HBond acceptors 5
    Atoms 51
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1859731.