KEGG   DRUG: D01698Help
Entry
D01698                      Drug                                   

Name
Dalcotidine (JAN/INN);
KU 1257
Formula
C18H29N3O2
Exact mass
319.226
Mol weight
319.4418
Structure
Mol fileKCF fileDB searchJmolKegDraw
Target
H2-receptor antagonist [HSA:3274] [KO:K04150]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04971  Gastric acid secretion  
 
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    H2-receptor
     Dalcotidine
      D01698  Dalcotidine (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 
120958-90-9
PubChem: 
LigandBox: 
KCF data Show

ATOM        23
            1   C1x C    14.7700  -23.2400
            2   C1x C    14.7700  -21.8400
            3   C1x C    16.0300  -21.1400
            4   C1x C    17.2900  -21.8400
            5   N1y N    17.2900  -23.2400
            6   C1x C    16.0300  -23.9400
            7   C1b C    18.4800  -23.9400
            8   C8y C    19.6700  -23.2400
            9   C8x C    19.6700  -21.8400
            10  C8x C    20.9300  -21.1400
            11  C8x C    22.1200  -21.8400
            12  C8y C    22.1200  -23.2400
            13  C8x C    20.9300  -23.9400
            14  O2a O    23.3100  -23.9400
            15  C1b C    24.5000  -23.2400
            16  C1b C    25.7600  -23.9400
            17  C1b C    26.9500  -23.2400
            18  N1b N    28.1400  -23.8700
            19  C5a C    29.3300  -23.2400
            20  N1b N    30.5200  -23.8700
            21  C1b C    31.7100  -23.2400
            22  O5a O    29.3300  -21.8400
            23  C1a C    32.9000  -23.8700
BOND        24
            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     5   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15   12  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   19  22 2
            24   21  23 1

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