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canSAR1967145
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NAMES
    SMILES
    COc1ccc(-c2nnc(SCC(=O)Nc3c(F)cc(F)cc3Br)n2C)cc1
    InChI
    InChI=1S/C18H15BrF2N4O2S/c1-25-17(10-3-5-12(27-2)6-4-10)23-24-18(25)28-9-15(26)22-16-13(19)7-11(20)8-14(16)21/h3-8H,9H2,1-2H3,(H,22,26)
    MOLECULAR FORMULA
    C18H15BrF2N4O2S
    CROSS REFERENCES
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    canSAR1967145

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.01
    AlogP 4.26
    HBond donors 1
    HBond acceptors 6
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1967145.