KEGG   DRUG: Zalunfiban
Entry
D12051                      Drug                                   
Name
Zalunfiban (USAN)
Formula
C16H18N8O2S
Exact mass
386.1273
Mol weight
386.4315
Structure
Remark
Chemical structure group: DG03167
Efficacy
Platelet aggregation inhibitor, Glycoprotein IIb/IIIa receptor antagonist
Comment
Treatment of ST segment elevated myocardial infarction
Target
ITGA2B/ITGB3 [HSA:3674 3690] [KO:K06476 K06493]
  Pathway
hsa04611  Platelet activation
hsa04640  Hematopoietic cell lineage
Brite
Target-based classification of drugs [BR:br08310]
 Cell surface molecules and ligands
  Cell adhesion molecules: other families
   Integrins
    ITGA2B/ITGB3
     D12051  Zalunfiban (USAN)
Other DBs
CAS: 1448313-27-6
LinkDB
KCF data

ATOM        27
            1   N4y N    13.5100  -18.5500
            2   C8y C    13.5100  -19.9500
            3   N5x N    14.7224  -20.6500
            4   C8y C    15.9349  -19.9500
            5   C8x C    15.9349  -18.5500
            6   C8y C    14.7224  -17.8500
            7   O5x O    14.7224  -16.4502
            8   N5x N    12.1785  -18.1174
            9   C8y C    11.3556  -19.2500
            10  S2x S    12.1785  -20.3826
            11  C8y C     9.9400  -19.2500
            12  C8x C     9.2400  -18.0376
            13  N5x N     7.8400  -18.0376
            14  C8x C     7.1400  -19.2500
            15  C8y C     7.8400  -20.4624
            16  C8x C     9.2400  -20.4624
            17  N1b N     7.1496  -21.6579
            18  C5a C     5.7403  -21.6580
            19  O5a O     5.0279  -20.4246
            20  C1b C     5.0523  -22.8494
            21  N1a N     3.6403  -22.8496
            22  N1y N    17.1660  -20.6610
            23  C1x C    17.1657  -22.0499
            24  C1x C    18.3780  -22.7502
            25  N1x N    19.5906  -22.0505
            26  C1x C    19.5909  -20.6616
            27  C1x C    18.3786  -19.9613
BOND        30
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     6   7 2
            8     1   8 1
            9     8   9 2
            10    9  10 1
            11    2  10 1
            12    9  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19   15  17 1
            20   17  18 1
            21   18  19 2
            22   18  20 1
            23   20  21 1
            24    4  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   22  27 1

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