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canSAR1769421
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NAMES
    SMILES
    COc1cccc(N2CCN(CC(=O)Nc3ccc(S(=O)(=O)N4CCCCCC4)cc3)CC2)c1
    InChI
    InChI=1S/C25H34N4O4S/c1-33-23-8-6-7-22(19-23)28-17-15-27(16-18-28)20-25(30)26-21-9-11-24(12-10-21)34(31,32)29-13-4-2-3-5-14-29/h6-12,19H,2-5,13-18,20H2,1H3,(H,26,30)
    MOLECULAR FORMULA
    C25H34N4O4S
    CROSS REFERENCES
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    canSAR1769421

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.23
    AlogP 3.02
    HBond donors 1
    HBond acceptors 8
    Atoms 68
    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 canSAR1769421.