KEGG   DRUG: DasolampanelHelp
Entry
D10107                      Drug                                   

Name
Dasolampanel (USAN)
Formula
C17H20ClN5O3
Exact mass
377.1255
Mol weight
377.8254
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Efficacy
Pain relief, AMPA receptor antagonist, Kainate receptor antagonist
Comment
Treatment of chronic pain
Target
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04724  Glutamatergic synapse
hsa04728  Dopaminergic synapse
Brite
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   Glutamate (ionotropic), non-NMDA
    GRIA
     D10107  Dasolampanel (USAN)
    GRIK
     D10107  Dasolampanel (USAN)
BRITE hierarchy
Other DBs
CAS: 503294-13-1
PubChem: 135626825
ChEMBL: CHEMBL2103869
PDB-CCD: SXI[PDBj]
LigandBox: D10107
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1y C    20.3112  -21.8514
            2   N1x N    20.3112  -23.2522
            3   C1x C    21.5018  -23.9525
            4   C1y C    22.6925  -23.2522
            5   C1y C    22.6925  -21.8514
            6   C1x C    21.5018  -21.1510
            7   C1x C    23.9532  -23.9525
            8   C1x C    25.1438  -23.2522
            9   C1y C    25.1438  -21.8514
            10  C1x C    23.9532  -21.1510
            11  C6a C    19.0505  -21.1510
            12  O2a O    26.3345  -21.1510
            13  O6a O    17.8598  -21.7814
            14  O6a O    19.0505  -19.7502
            15  C8y C    27.5251  -21.8514
            16  C8x C    27.5251  -23.2522
            17  C8x C    28.7858  -23.9525
            18  C8x C    29.9765  -23.2522
            19  C8y C    29.9765  -21.8514
            20  C8y C    28.7858  -21.1510
            21  C8y C    28.7858  -19.7502
            22  X   Cl   31.1671  -21.1510
            23  N5x N    27.6652  -18.9798
            24  N4x N    29.9765  -18.9798
            25  N5x N    29.5562  -17.6491
            26  N5x N    28.0854  -17.6491
BOND        29
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    1  11 1 #Down
            13    9  12 1 #Up
            14   11  13 1
            15   11  14 2
            16   12  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   15  20 1
            23   20  21 1
            24   19  22 1
            25   23  21 2
            26   21  24 1
            27   24  25 1
            28   25  26 2
            29   23  26 1

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