KEGG   DRUG: Bropirimine
Entry
D01666                      Drug                                   
Name
Bropirimine (JAN/USAN/INN)
Formula
C10H8BrN3O
Exact mass
264.9851
Mol weight
266.09
Structure
Simcomp
Remark
Same as: C13127
Efficacy
Antineoplastic, Antiviral, Toll-like receptor agonist
Target
TLR7 [HSA:51284] [KO:K05404]
  Pathway
hsa04613  Neutrophil extracellular trap formation
hsa04620  Toll-like receptor signaling pathway
Brite
Target-based classification of drugs [BR:br08310]
 Cytokines and receptors
  Pattern recognition receptors
   Toll-like receptors
    TLR7
     D01666  Bropirimine (JAN/USAN/INN)
Other DBs
CAS: 56741-95-8
PubChem: 7848729
ChEBI: 31307
PDB-CCD: 977[PDBj]
LigandBox: D01666
NIKKAJI: J34.706J
LinkDB
KCF data

ATOM        15
            1   C8y C    23.2418  -13.3982
            2   C8y C    24.4535  -14.1006
            3   C8y C    24.4494  -15.5036
            4   N4x N    23.2374  -16.1980
            5   C8y C    22.0259  -15.4956
            6   N5x N    22.0264  -14.0987
            7   X   Br   25.6679  -13.4032
            8   O5x O    23.2437  -11.9977
            9   N1a N    20.8124  -16.1944
            10  C8y C    25.6307  -16.1900
            11  C8x C    25.6267  -17.5700
            12  C8x C    26.8371  -18.2735
            13  C8x C    28.0515  -17.5770
            14  C8x C    28.0555  -16.1970
            15  C8x C    26.8451  -15.4935
BOND        16
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 2
            6     6   1 1
            7     2   7 1
            8     1   8 2
            9     5   9 1
            10    3  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   10  15 1

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