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canSAR2001226
FEATURES
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NAMES
    SMILES
    Cc1ccc(NC(=O)CNc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C
    InChI
    InChI=1S/C21H28N4O4S/c1-16-4-5-18(14-20(16)30(27,28)24(2)3)23-21(26)15-22-17-6-8-19(9-7-17)25-10-12-29-13-11-25/h4-9,14,22H,10-13,15H2,1-3H3,(H,23,26)
    MOLECULAR FORMULA
    C21H28N4O4S
    CROSS REFERENCES
    2001226 logo

    canSAR2001226

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.18
    AlogP 2.13
    HBond donors 2
    HBond acceptors 8
    Atoms 58
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2001226.