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canSAR499578
FEATURES
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NAMES
    SMILES
    O=C1CCN1c1ccc2on(C[C@@H]3C[C@H]4c5ccccc5Oc5ccc(Br)cc5[C@H]4O3)c2c1
    InChI
    InChI=1S/C26H21BrN2O4/c27-15-5-7-23-20(11-15)26-19(18-3-1-2-4-22(18)32-23)13-17(31-26)14-29-21-12-16(6-8-24(21)33-29)28-10-9-25(28)30/h1-8,11-12,17,19,26H,9-10,13-14H2/t17-,19-,26-/m0/s1
    MOLECULAR FORMULA
    C26H21BrN2O4
    CROSS REFERENCES
    499578 logo

    canSAR499578

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.07
    AlogP 6.15
    HBond donors 0
    HBond acceptors 6
    Atoms 54
    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 canSAR499578.