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canSAR2016741
FEATURES
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NAMES
    SMILES
    O=C(CN1CCN(S(=O)(=O)c2ccc(Br)s2)CC1)NCC1CCCCC1
    InChI
    InChI=1S/C17H26BrN3O3S2/c18-15-6-7-17(25-15)26(23,24)21-10-8-20(9-11-21)13-16(22)19-12-14-4-2-1-3-5-14/h6-7,14H,1-5,8-13H2,(H,19,22)
    MOLECULAR FORMULA
    C17H26BrN3O3S2
    CROSS REFERENCES
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    canSAR2016741

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.06
    AlogP 2.51
    HBond donors 1
    HBond acceptors 6
    Atoms 52
    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 canSAR2016741.