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canSAR1126924
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NAMES
    SMILES
    COc1cccc(N(CC(Cn2c3ccc(Br)cc3c3cc(Br)ccc32)OC(C)=O)S(=O)(=O)c2ccc(C)cc2)c1
    InChI
    InChI=1S/C31H28Br2N2O5S/c1-20-7-11-27(12-8-20)41(37,38)35(24-5-4-6-25(17-24)39-3)19-26(40-21(2)36)18-34-30-13-9-22(32)15-28(30)29-16-23(33)10-14-31(29)34/h4-17,26H,18-19H2,1-3H3
    MOLECULAR FORMULA
    C31H28Br2N2O5S
    CROSS REFERENCES
    1126924 logo

    canSAR1126924

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 698.01
    AlogP 7.46
    HBond donors 0
    HBond acceptors 7
    Atoms 69
    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 canSAR1126924.