Entry |
|
Name |
Icopezil maleate (USAN) |
Formula |
C23H25N3O2. C4H4O4
|
Exact mass |
491.2056
|
Mol weight |
491.5357
|
Structure |
|
Class |
Neuropsychiatric agent
DG01595 Cholinesterase inhibitor
DG01593 Acetylcholinesterase inhibitor
|
Efficacy |
Dementia therapeutic agent, Acetylcholinesterase inhibitor |
Comment |
Alzheimer's disease treatment (cognition adjuvant)
|
Target |
|
Pathway |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01595 Cholinesterase inhibitor
DG01593 Acetylcholinesterase inhibitor
D03751 Icopezil maleate
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Carboxylic-ester hydrolases
ACHE
D03751 Icopezil maleate (USAN)
|
Other DBs |
|
KCF data |
ATOM 36
1 C1b C 19.8100 -19.8800
2 C1b C 21.0700 -20.5800
3 C1y C 22.2600 -19.8800
4 C1x C 22.2600 -18.5500
5 C1x C 23.4500 -20.5800
6 C1x C 23.4500 -17.8500
7 C1x C 24.6400 -19.9500
8 N1y N 24.6400 -18.5500
9 C1b C 25.9000 -17.8500
10 C8y C 27.0900 -18.5500
11 C8x C 28.2800 -17.8500
12 C8x C 27.0900 -19.9500
13 C8x C 29.4700 -18.5500
14 C8x C 28.2800 -20.5800
15 C8x C 29.4700 -19.9500
16 C8y C 18.6200 -20.5800
17 N5x N 18.6200 -21.9800
18 O2x O 17.2900 -22.4000
19 C8y C 16.5200 -21.2800
20 C8y C 17.2900 -20.1600
21 C8x C 15.1200 -21.2800
22 C8y C 14.4200 -20.0900
23 C8y C 15.0500 -18.9000
24 C8x C 16.4500 -18.9000
25 N1x N 12.9500 -19.8100
26 C5x C 12.9500 -18.4800
27 C1x C 14.1400 -17.9200
28 O5x O 11.6900 -17.7800
29 C2b C 33.8800 -18.8300
30 C2b C 35.6300 -18.8300
31 C6a C 33.1800 -20.0900
32 C6a C 36.3300 -20.0900
33 O6a O 37.7300 -20.0900
34 O6a O 31.7800 -20.0900
35 O6a O 33.8800 -21.2800
36 O6a O 35.6300 -21.2800
BOND 39
1 1 2 1
2 2 3 1
3 3 4 1
4 3 5 1
5 4 6 1
6 5 7 1
7 6 8 1
8 8 9 1
9 9 10 1
10 10 11 2
11 10 12 1
12 11 13 1
13 12 14 2
14 13 15 2
15 7 8 1
16 14 15 1
17 1 16 1
18 16 17 2
19 17 18 1
20 18 19 1
21 19 20 1
22 16 20 1
23 19 21 2
24 21 22 1
25 22 23 2
26 23 24 1
27 24 20 2
28 22 25 1
29 25 26 1
30 26 27 1
31 23 27 1
32 26 28 2
33 29 30 2
34 29 31 1
35 30 32 1
36 32 33 2
37 31 34 1
38 31 35 2
39 32 36 1
|