KEGG   DRUG: D03654Help
Entry
D03654                      Drug                                   

Name
Darifenacin (USAN/INN)
Product
Formula
C28H30N2O2
Exact mass
426.2307
Mol weight
426.55
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment for an overactive bladder
Remark
ATC code: 
Target
muscarinic cholinergic receptor M3 antagonist [HSA:1131] [KO:K04131]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04970  Salivary secretion
hsa04971  Gastric acid secretion
hsa04972  Pancreatic secretion  
 
Metabolism
Enzyme: CYP3A [HSA:1576 1577 1551]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G04 UROLOGICALS
   G04B UROLOGICALS
    G04BD Urinary antispasmodics
     G04BD10 Darifenacin
      D03654  Darifenacin (USAN/INN)
USP drug classification [BR:br08302]
 Genitourinary Agents
  Antispasmodics, Urinary
   Darifenacin
    D03654  Darifenacin (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor M3 [HSA:1131] [KO:K04131]
     Darifenacin [ATC:G04BD10]
      D03654  Darifenacin (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
133099-04-4
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        32
            1   C1x C    25.0600  -22.1200
            2   C1x C    26.4600  -22.1200
            3   C1y C    26.8926  -20.7885
            4   C1x C    25.7600  -19.9656
            5   N1y N    24.6274  -20.7885
            6   C1b C    23.4276  -20.0900
            7   C1b C    22.2151  -20.7900
            8   C8y C    21.0027  -20.0900
            9   C8x C    19.7903  -20.7900
            10  C8y C    18.5778  -20.0900
            11  C1d C    28.0924  -20.0900
            12  C8y C    29.3049  -20.7900
            13  C8y C    28.0899  -18.6901
            14  C8x C    29.2861  -17.9965
            15  C8x C    29.2835  -16.5965
            16  C8x C    28.0697  -15.8988
            17  C8x C    26.8735  -16.5924
            18  C8x C    26.8761  -17.9924
            19  C8x C    29.3049  -22.1900
            20  C8x C    30.5173  -22.8900
            21  C8x C    31.7297  -22.1900
            22  C8x C    31.7297  -20.7900
            23  C8x C    30.5173  -20.0900
            24  C8x C    21.0027  -18.6900
            25  C8x C    19.7903  -17.9900
            26  C8y C    18.5778  -18.6900
            27  O2x O    17.2463  -18.2574
            28  C1x C    16.4234  -19.3900
            29  C1x C    17.2463  -20.5226
            30  C5a C    31.1249  -18.4800
            31  O5a O    32.3296  -19.2341
            32  N1a N    31.1747  -17.0802
BOND        36
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     5   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    3  11 1 #Down
            12   11  12 1
            13   11  13 1
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   13  18 2
            20   12  19 2
            21   19  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 2
            25   12  23 1
            26    8  24 1
            27   24  25 2
            28   25  26 1
            29   26  10 2
            30   26  27 1
            31   27  28 1
            32   28  29 1
            33   10  29 1
            34   11  30 1
            35   30  31 2
            36   30  32 1

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