KEGG   DRUG: Frunexian hydrochloride
Entry
D12564                      Drug                                   
Name
Frunexian hydrochloride (USAN)
Formula
C19H26N4O4. HCl
Exact mass
410.1721
Mol weight
410.89
Structure
Remark
Chemical structure group: DG03261
Efficacy
Antithrombotic, Factor XIa inhibitor
Comment
Prevention of thromboembolism without causing bleeding; inhibitor of coagulation factor XIa
Target
F11a [CPD:C03262] [HSA:2160] [KO:K01323]
  Pathway
hsa04610  Complement and coagulation cascades
Brite
Target-based classification of drugs [BR:br08310]
 Peptidases and inhibitors
  Serine peptidases
   Chymotrypsin family
    F11a
     D12564  Frunexian hydrochloride (USAN)
Other DBs
CAS: 2416857-24-2
PubChem: 497620977
LinkDB
KCF data

ATOM        28
            1   C6a C    18.9773  -17.7824
            2   O6a O    20.1721  -18.4853
            3   O6a O    17.7824  -18.4853
            4   C1y C    18.9773  -16.3767
            5   C1y C    19.9613  -15.3927
            6   C5x C    18.9773  -14.4087
            7   N1y N    17.9933  -15.3927
            8   O5x O    18.9773  -13.0030
            9   C5a C    16.5876  -15.3927
            10  C1b C    21.3670  -15.3927
            11  O5a O    15.8847  -14.1979
            12  N1b N    15.8847  -16.5876
            13  C1c C    14.4790  -16.5876
            14  C1y C    13.7762  -17.8527
            15  C1a C    13.7762  -15.3927
            16  C1x C    12.3705  -17.8527
            17  C1x C    11.6676  -19.0476
            18  C1x C    12.3705  -20.2424
            19  C1x C    13.7762  -20.2424
            20  C1x C    14.4790  -19.0476
            21  C8y C    22.0698  -14.1979
            22  C8x C    23.4755  -14.1979
            23  C8y C    24.1784  -12.9328
            24  N5x N    23.4755  -11.7379
            25  C8x C    22.0698  -11.7379
            26  C8x C    21.3670  -12.9328
            27  N1a N    25.5841  -12.9328
            28  X   Cl   26.2500  -18.5500
BOND        29
            1     1   2 1
            2     1   3 2
            3     4   1 1 #Up
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     4   7 1
            8     6   8 2
            9     7   9 1
            10    5  10 1 #Down
            11    9  11 2
            12    9  12 1
            13   12  13 1
            14   13  14 1
            15   13  15 1 #Up
            16   14  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   14  20 1
            22   10  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   21  26 1
            29   23  27 1

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