KEGG   DRUG: Sofpironium bromide
Entry
D10989                      Drug                                   

Name
Sofpironium bromide (JAN/USAN/INN);
Ecclock (TN)
Formula
C22H32NO5. Br
Exact mass
469.1464
Mol weight
470.3972
Structure
Simcomp
Remark
Therapeutic category: 1259
Product: D10989<JP>
Efficacy
Anhidrotic
Comment
Quaternary ammonium compound
Topical treatment of hyperhidrosis
Target
CHRM3 [HSA:1131] [KO:K04131]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  12  Agents affecting peripheral nervous system
   125  Diaphoretics, anhidrotics
    1259  Others
     D10989  Sofpironium bromide (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM3
     D10989  Sofpironium bromide (JAN/USAN/INN) <JP>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D10989
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10989
Other DBs
CAS: 1628106-94-4
PubChem: 342581830
ChEMBL: CHEMBL3707223
LinkDB
KCF data

ATOM        29
            1   C1d C    20.4629  -17.2672
            2   C7a C    19.3299  -17.9045
            3   O7a O    18.1260  -17.2672
            4   O6a O    19.3299  -19.3208
            5   C1y C    16.8513  -17.9754
            6   C1x C    15.7726  -17.1964
            7   C1x C    16.4506  -19.3412
            8   N2y N    14.6153  -17.9877 #+
            9   C1x C    15.0891  -19.3016
            10  C1y C    21.6814  -17.9890
            11  C1x C    22.1205  -19.3170
            12  C1x C    23.5217  -19.3136
            13  C1x C    23.9513  -17.9798
            14  C1x C    22.8157  -17.1591
            15  C8y C    20.4629  -15.8509
            16  C8x C    21.6894  -15.1427
            17  C8x C    21.6894  -13.7265
            18  C8x C    20.4629  -13.0183
            19  C8x C    19.2364  -13.7265
            20  C8x C    19.2364  -15.1427
            21  O1a O    21.5478  -16.4174
            22  C1b C    13.2300  -17.9880
            23  C7a C    12.5283  -19.1995
            24  O7a O    11.1283  -19.1975
            25  C1b C    10.4266  -20.4089
            26  C1a C     9.0266  -20.4070
            27  C1a C    13.9030  -16.6354
            28  O6a O    13.2187  -20.3989
            29  X   Br   15.1900  -14.9800 #-
BOND        30
            1     1   2 1
            2     2   3 1
            3     2   4 2
            4     5   3 1 #Down
            5     5   6 1
            6     5   7 1
            7     6   8 1
            8     7   9 1
            9     8   9 1
            10    1  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   10  14 1
            16    1  15 1
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   19  20 1
            22   15  20 2
            23    1  21 1 #Up
            24    8  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29    8  27 1
            30   23  28 2

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