KEGG   DRUG: Omapatrilat
Entry
D01970                      Drug                                   
Name
Omapatrilat (JAN/USAN/INN);
BMS 186716
Formula
C19H24N2O4S2
Exact mass
408.1178
Mol weight
408.54
Structure
Class
Cardiovascular agent
 DG03345  Neprilysin inhibitor
Efficacy
Antihypertensive, Neprilysin inhibitor
Comment
Treatment of hypertension and congestive heart failure
Target
MME (CD10) [HSA:4311] [KO:K01389]
  Pathway
hsa04614  Renin-angiotensin system
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG03345  Neprilysin inhibitor
   D01970  Omapatrilat
Target-based classification of drugs [BR:br08310]
 Peptidases and inhibitors
  Metallo peptidases
   Family M13
    MME (CD10)
     D01970  Omapatrilat (JAN/USAN/INN)
Other DBs
CAS: 167305-00-2
PubChem: 7849032
PDB-CCD: FT8[PDBj]
LigandBox: D01970
LinkDB
KCF data

ATOM        27
            1   C1x C    33.2960  -19.1343
            2   C1y C    33.6217  -17.7852
            3   C1x C    34.1799  -20.2507
            4   C5x C    34.8777  -17.1805
            5   S2x S    35.5754  -20.2507
            6   N1y N    36.1337  -17.7852
            7   C1y C    36.4593  -19.1343
            8   C1x C    37.8031  -19.5306
            9   C1x C    38.8182  -18.5649
            10  C1x C    38.4925  -17.2158
            11  C1y C    37.1488  -16.8196
            12  O5x O    34.8748  -15.7799
            13  N1b N    32.5286  -16.9022
            14  C5a C    31.3216  -17.5855
            15  C1c C    30.1239  -16.8752
            16  C1b C    28.9104  -17.5568
            17  C8y C    27.7134  -16.8469
            18  O5a O    31.3050  -18.9988
            19  S1a S    30.1404  -15.4730
            20  C8x C    27.7298  -15.4451
            21  C8x C    26.5249  -14.7305
            22  C8x C    25.3033  -15.4166
            23  C8x C    25.2869  -16.8185
            24  C8x C    26.4920  -17.5332
            25  C6a C    37.1488  -15.4196
            26  O6a O    38.3857  -14.7056
            27  O6a O    35.9441  -14.7238
BOND        29
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1
            6     5   7 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12    6  11 1
            13    4  12 2
            14    2  13 1 #Down
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   14  18 2
            20   15  19 1 #Down
            21   17  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   17  24 1
            27   11  25 1 #Down
            28   25  26 1
            29   25  27 2

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