KEGG   DRUG: Obefazimod
Entry
D12345                      Drug                                   
Name
Obefazimod (USAN)
Formula
C16H10ClF3N2O
Exact mass
338.0434
Mol weight
338.71
Structure
Efficacy
Anti-inflammatory
Comment
Treatment of ulcerative colitis and Crohn's disease and rheumatoid arthritis
Target
NCBP [HSA:4686 22916 392517] [KO:K12882 K12883]
  Pathway
hsa03013  Nucleocytoplasmic transport
hsa03015  mRNA surveillance pathway
hsa03040  Spliceosome
Brite
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Genetic information processing
   Spliceosome
    NCBP
     D12345  Obefazimod (USAN)
Other DBs
CAS: 1258453-75-6
PubChem: 497620758
LinkDB
KCF data

ATOM        23
            1   C8x C     8.0500  -14.7700
            2   C8x C     8.0500  -16.1700
            3   C8x C     9.2624  -16.8700
            4   C8y C    10.4749  -16.1700
            5   C8y C    10.4749  -14.7700
            6   C8y C     9.2624  -14.0700
            7   C8x C    11.6873  -16.8700
            8   C8x C    12.8997  -16.1700
            9   C8y C    12.8997  -14.7700
            10  N5x N    11.6873  -14.0700
            11  N1b N    14.0973  -14.0785
            12  C8y C    15.2856  -14.7645
            13  C8x C    15.2857  -16.1698
            14  C8x C    16.4981  -16.8697
            15  C8y C    17.7105  -16.1696
            16  C8x C    17.7104  -14.7644
            17  C8x C    16.4980  -14.0645
            18  O2a O    18.9228  -16.8694
            19  C1d C    20.1177  -16.1792
            20  X   F    21.3301  -15.4792
            21  X   F    19.4177  -14.9668
            22  X   F    20.8177  -17.3917
            23  X   Cl    9.2624  -12.6702
BOND        25
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   12  17 1
            20   15  18 1
            21   18  19 1
            22   19  20 1
            23   19  21 1
            24   19  22 1
            25    6  23 1

» Japanese version   » Back

DBGET integrated database retrieval system