KEGG   DRUG: Lorundrostat
Entry
D12773                      Drug                                   
Name
Lorundrostat (USAN/INN)
Formula
C24H33N7O2
Exact mass
451.2696
Mol weight
451.5645
Structure
Remark
Chemical structure group: DG03289
Efficacy
Antihypertensive, Aldosterone synthase inhibitor
Comment
Treatment of aldosterone dependent cardiorenal conditions such as hypertension, chronic kidney disease and congestive heart failure
Target
CYP11B2 [HSA:1585] [KO:K07433]
  Pathway
hsa00140  Steroid hormone biosynthesis
hsa04925  Aldosterone synthesis and secretion
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Cytochrome P450
    CYP11B2
     D12773  Lorundrostat (USAN/INN)
Other DBs
CAS: 1820940-17-7
LinkDB
KCF data

ATOM        33
            1   C8x C     7.1400  -16.8700
            2   C8y C     7.1400  -18.2700
            3   C8x C     8.3300  -18.9700
            4   C8x C     9.5900  -18.2700
            5   C8y C     9.5900  -16.8700
            6   C8x C     8.3300  -16.1700
            7   C8y C    10.7800  -16.1700
            8   C1a C     5.9500  -18.9700
            9   N5x N    11.9700  -16.8700
            10  C8y C    13.2300  -16.1700
            11  N5x N    13.2300  -14.7700
            12  N5x N    12.0400  -14.0700
            13  C8x C    10.7800  -14.7700
            14  N1y N    14.4200  -16.8700
            15  C1x C    14.4200  -18.2700
            16  C1x C    15.6800  -18.9700
            17  N1y N    16.8700  -18.2700
            18  C1x C    16.8700  -16.8700
            19  C1x C    15.6800  -16.1700
            20  C1b C    18.0600  -18.9700
            21  C5a C    19.2500  -18.2700
            22  N1b N    20.4400  -18.9700
            23  O5a O    19.2500  -16.8700
            24  C1y C    21.6300  -18.2700
            25  C1x C    22.8200  -18.9700
            26  C1x C    24.0800  -18.2700
            27  C1y C    24.0800  -16.8700
            28  C1x C    22.8900  -16.1700
            29  C1x C    21.6300  -16.8700
            30  N1b N    25.2700  -16.1700
            31  C5a C    26.4600  -16.8700
            32  C1a C    27.6500  -16.1700
            33  O5a O    26.4600  -18.2700
BOND        36
            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     5   7 1
            8     2   8 1
            9     7   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    7  13 2
            15   10  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   14  19 1
            22   17  20 1
            23   20  21 1
            24   21  22 1
            25   21  23 2
            26   24  22 1 #Down
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   27  28 1
            31   28  29 1
            32   24  29 1
            33   27  30 1 #Up
            34   30  31 1
            35   31  32 1
            36   31  33 2

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