KEGG   DRUG: RacecadotrilHelp
Entry
D08464                      Drug                                   

Name
Racecadotril (INN);
Tiorfan (TN);
Hidrasec (TN)
Formula
C21H23NO4S
Exact mass
385.1348
Mol weight
385.4766
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-allergic agent
 DG01957  Antidiarrheal
Remark
ATC code: A07XA04
Efficacy
Antidiarrheal, Enkephalinase inhibitor
Comment
See Ecadotril [DR:D03929]
Target
MME (CD10) [HSA:4311] [KO:K01389]
  Pathway
hsa04974  Protein digestion and absorption
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A07 ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
   A07X OTHER ANTIDIARRHEALS
    A07XA Other antidiarrheals
     A07XA04 Racecadotril
      D08464  Racecadotril (INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Metallo peptidases
    MME (CD10)
     D08464  Racecadotril (INN)
BRITE hierarchy
Other DBs
CAS: 81110-73-8
PubChem: 96025150
ChEMBL: CHEMBL2103772
LigandBox: D08464
LinkDB All DBs
KCF data Show

ATOM        27
            1   C8x C    10.7800  -15.5400
            2   C8x C    10.7800  -16.9400
            3   C8x C    12.0400  -17.6400
            4   C8x C    13.2300  -16.9400
            5   C8y C    13.2300  -15.5400
            6   C8x C    12.0400  -14.8400
            7   C1c C    15.6100  -15.5400
            8   C1b C    14.3500  -14.8400
            9   N1b N    18.0600  -15.5400
            10  C5a C    16.8000  -14.8400
            11  O5a O    16.8000  -13.4400
            12  C1b C    19.2500  -14.8400
            13  C7a C    20.4400  -15.5400
            14  O7a O    21.6300  -14.8400
            15  O6a O    20.4400  -16.9400
            16  C1b C    22.8200  -15.5400
            17  C8y C    24.0100  -14.8400
            18  C8x C    25.2000  -15.5400
            19  C8x C    26.4600  -14.8400
            20  C8x C    26.4600  -13.4400
            21  C8x C    25.2700  -12.7400
            22  C8x C    24.0100  -13.4400
            23  C1b C    15.6100  -16.9400
            24  O5a O    15.6100  -19.6700
            25  S2a S    16.8166  -17.6500
            26  C5a C    16.8051  -19.0400
            27  C1a C    17.9971  -19.7659
BOND        28
            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     7   8 1
            8     5   8 1
            9     9  10 1
            10    7  10 1
            11   10  11 2
            12    9  12 1
            13   12  13 1
            14   13  14 1
            15   13  15 2
            16   14  16 1
            17   16  17 1
            18   17  18 2
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23   17  22 1
            24    7  23 1
            25   23  25 1
            26   25  26 1
            27   26  24 2
            28   26  27 1

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