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canSAR1590852
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NAMES
    SMILES
    COc1ccccc1/C=C/C=NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1
    InChI
    InChI=1S/C23H28N4O4S/c1-19-9-11-21(12-10-19)32(29,30)27-16-14-26(15-17-27)18-23(28)25-24-13-5-7-20-6-3-4-8-22(20)31-2/h3-13H,14-18H2,1-2H3,(H,25,28)/b7-5+,24-13?
    MOLECULAR FORMULA
    C23H28N4O4S
    CROSS REFERENCES
    1590852 logo

    canSAR1590852

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.18
    AlogP 2.13
    HBond donors 1
    HBond acceptors 8
    Atoms 60
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1590852.