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canSAR502844
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccc(S(=O)(=O)NC(CC#CCN2CCOCC2)C(=O)O)cc1)c1ccc(Br)cc1
    InChI
    InChI=1S/C23H24BrN3O6S/c24-18-6-4-17(5-7-18)22(28)25-19-8-10-20(11-9-19)34(31,32)26-21(23(29)30)3-1-2-12-27-13-15-33-16-14-27/h4-11,21,26H,3,12-16H2,(H,25,28)(H,29,30)
    MOLECULAR FORMULA
    C23H24BrN3O6S
    CROSS REFERENCES
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    canSAR502844

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 549.06
    AlogP 2.16
    HBond donors 3
    HBond acceptors 9
    Atoms 58
    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 canSAR502844.