canSAR738856
FEATURES
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NAMES
    SMILES
    Cc1ccc(Nc2nc(N/N=C/c3cc(Br)cc(Br)c3O)nc(N3CCOCC3)n2)cc1Cl
    InChI
    InChI=1S/C21H20Br2ClN7O2/c1-12-2-3-15(10-17(12)24)26-19-27-20(29-21(28-19)31-4-6-33-7-5-31)30-25-11-13-8-14(22)9-16(23)18(13)32/h2-3,8-11,32H,4-7H2,1H3,(H2,26,27,28,29,30)/b25-11+
    MOLECULAR FORMULA
    C21H20Br2ClN7O2
    CROSS REFERENCES
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    canSAR738856
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight594.97
    AlogP5.09
    HBond donors3
    HBond acceptors9
    Atoms53
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR738856.