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canSAR1121459
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NAMES
    SMILES
    Brc1cccc(Sc2ncccc2OCCc2cccnc2)c1
    InChI
    InChI=1S/C18H15BrN2OS/c19-15-5-1-6-16(12-15)23-18-17(7-3-10-21-18)22-11-8-14-4-2-9-20-13-14/h1-7,9-10,12-13H,8,11H2
    MOLECULAR FORMULA
    C18H15BrN2OS
    CROSS REFERENCES
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    canSAR1121459

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.01
    AlogP 5.01
    HBond donors 0
    HBond acceptors 3
    Atoms 38
    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 canSAR1121459.