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canSAR1981184
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NAMES
    SMILES
    COc1ccc2oc(-c3cccc(NC(=O)CSc4ccc(Cl)cc4)c3)nc2c1
    InChI
    InChI=1S/C22H17ClN2O3S/c1-27-17-7-10-20-19(12-17)25-22(28-20)14-3-2-4-16(11-14)24-21(26)13-29-18-8-5-15(23)6-9-18/h2-12H,13H2,1H3,(H,24,26)
    MOLECULAR FORMULA
    C22H17ClN2O3S
    CROSS REFERENCES
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    canSAR1981184

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.06
    AlogP 5.89
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1981184.