KEGG   DRUG: AfloqualoneHelp
Entry
D01638                      Drug                                   

Name
Afloqualone (JP17/INN);
Airomate (TN)
Formula
C16H14FN3O
Exact mass
283.1121
Mol weight
283.3003
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Therapeutic category: 1249
Product: D01638<JP>
Efficacy
Muscle relaxant
Comment
Quinazolinone derivative
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  12  Agents affecting peripheral nervous system
   124  Antispasmodics
    1249  Others
     D01638  Afloqualone (JP17/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01638  Afloqualone
BRITE hierarchy
Other DBs
CAS: 56287-74-2
PubChem: 7848701
ChEBI: 31177
ChEMBL: CHEMBL2105918
LigandBox: D01638
NIKKAJI: J3.197F
LinkDB All DBs
KCF data Show

ATOM        21
            1   C8y C    17.5791  -17.6924
            2   C8x C    17.5791  -19.0929
            3   C8x C    18.7949  -19.7932
            4   C8x C    18.7949  -16.9921
            5   C8y C    20.0036  -17.6924
            6   C8y C    19.9975  -19.0929
            7   N5x N    21.2074  -19.7983
            8   C8y C    22.4234  -19.1033
            9   N4y N    22.4294  -17.7027
            10  C8y C    21.2195  -16.9974
            11  C8y C    23.6452  -17.0077
            12  O5x O    21.2254  -15.5968
            13  C1b C    23.6333  -19.8086
            14  N1a N    16.3665  -16.9914
            15  C8x C    24.8514  -17.7163
            16  C8x C    26.0674  -17.0213
            17  C8x C    26.0733  -15.6208
            18  C8x C    24.8634  -14.9154
            19  C8y C    23.6476  -15.6104
            20  C1a C    22.4367  -14.9066
            21  X   F    24.8492  -19.1136
BOND        23
            1    10   5 1
            2     9  11 1
            3     1   2 2
            4    10  12 2
            5     2   3 1
            6     8  13 1
            7     3   6 2
            8     1  14 1
            9     5   4 2
            10    4   1 1
            11    5   6 1
            12    6   7 1
            13    7   8 2
            14   11  15 2
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   18  19 2
            19   19  11 1
            20    8   9 1
            21   19  20 1
            22    9  10 1
            23   13  21 1

» Japanese version   » Back

DBGET integrated database retrieval system