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canSAR1111948
FEATURES
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NAMES
    SMILES
    COc1ccc(OC)c(COc2cc(NC(=O)c3ccc(Br)cc3)ccc2N(C)S(C)(=O)=O)c1
    InChI
    InChI=1S/C24H25BrN2O6S/c1-27(34(4,29)30)21-11-9-19(26-24(28)16-5-7-18(25)8-6-16)14-23(21)33-15-17-13-20(31-2)10-12-22(17)32-3/h5-14H,15H2,1-4H3,(H,26,28)
    MOLECULAR FORMULA
    C24H25BrN2O6S
    CROSS REFERENCES
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    canSAR1111948

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 548.06
    AlogP 4.69
    HBond donors 1
    HBond acceptors 8
    Atoms 59
    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 canSAR1111948.