KEGG   DRUG: IdalopirdineHelp
Entry
D10710                      Drug                                   

Name
Idalopirdine (USAN/INN)
Formula
C20H19F5N2O
Exact mass
398.1418
Mol weight
398.3697
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Chemical structure group: DG01878
Efficacy
Dementia therapeutic agent, Serotonin 5-HT6 receptor antagonist
Comment
Treatment of Alzheimer's type dementia
Target
HTR6 [HSA:3362] [KO:K04162]
HTR2C [HSA:3358] [KO:K04157]
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Serotonin
    HTR2C
     D10710  Idalopirdine (USAN/INN)
    HTR6
     D10710  Idalopirdine (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 467459-31-0
PubChem: 254741671
ChEMBL: CHEMBL3286580
LinkDB All DBs
KCF data Show

ATOM        28
            1   C8y C    20.1398  -15.7229
            2   C8x C    20.1398  -14.3373
            3   C8x C    21.3176  -13.6444
            4   C8x C    22.5647  -14.3373
            5   C8y C    22.5647  -15.7229
            6   C8x C    21.3176  -16.4157
            7   C1b C    18.8927  -16.4157
            8   N1b N    17.7842  -15.7229
            9   C1b C    16.6064  -16.4157
            10  C1b C    15.4286  -15.7229
            11  C8y C    14.2508  -16.4157
            12  C8x C    14.2508  -17.8014
            13  N4x N    12.9344  -18.1478
            14  C8y C    12.1030  -17.1086
            15  C8y C    12.9344  -16.0000
            16  C8x C    10.7173  -16.9700
            17  C8y C    10.1631  -15.6536
            18  C8x C    10.9945  -14.5451
            19  C8x C    12.3801  -14.6837
            20  X   F     8.7774  -15.5151
            21  O2a O    23.7425  -16.4157
            22  C1b C    24.9896  -15.7229
            23  C1d C    26.2025  -16.4499
            24  C1c C    27.4089  -15.7792
            25  X   F    28.6191  -16.5048
            26  X   F    27.4316  -14.3500
            27  X   F    25.5025  -17.6623
            28  X   F    26.9025  -17.6623
BOND        30
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   11  15 1
            17   14  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   15  19 2
            22   17  20 1
            23    5  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   24  26 1
            29   23  27 1
            30   23  28 1

» Japanese version   » Back

DBGET integrated database retrieval system