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canSAR1150828
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NAMES
    SMILES
    CC(=O)Nc1ccc(S(=O)(=O)N2CCN(CCCC3C(=O)NCCN=C3C)CC2)cc1
    InChI
    InChI=1S/C21H31N5O4S/c1-16-20(21(28)23-10-9-22-16)4-3-11-25-12-14-26(15-13-25)31(29,30)19-7-5-18(6-8-19)24-17(2)27/h5-8,20H,3-4,9-15H2,1-2H3,(H,23,28)(H,24,27)
    MOLECULAR FORMULA
    C21H31N5O4S
    CROSS REFERENCES
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    canSAR1150828

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.21
    AlogP 0.94
    HBond donors 2
    HBond acceptors 9
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1150828.