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canSAR1716236
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NAMES
    SMILES
    COc1ccc(-c2noc(C3CCCN(S(=O)(=O)c4cccc(Cl)c4)C3)n2)cc1OC
    InChI
    InChI=1S/C21H22ClN3O5S/c1-28-18-9-8-14(11-19(18)29-2)20-23-21(30-24-20)15-5-4-10-25(13-15)31(26,27)17-7-3-6-16(22)12-17/h3,6-9,11-12,15H,4-5,10,13H2,1-2H3
    MOLECULAR FORMULA
    C21H22ClN3O5S
    CROSS REFERENCES
    1716236 logo

    canSAR1716236

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.10
    AlogP 3.98
    HBond donors 0
    HBond acceptors 8
    Atoms 53
    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 canSAR1716236.