| Entry |
|
|---|
| Name |
Melperone hydrochloride;
Buronil (TN) |
|---|
| Formula |
C16H22FNO. HCl
|
|---|
| Exact mass |
299.1452
|
|---|
| Mol weight |
299.8113
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG03200 Antipsychotic agent
DG01940 Butyrophenone derivative
|
|---|
| Remark |
|
|---|
| Efficacy |
Neuroleptic |
|---|
| Comment |
Butyrophenone derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AD Butyrophenone derivatives
N05AD03 Melperone
D08172 Melperone hydrochloride
Drug groups [BR:br08330]
Neuropsychiatric agent
DG03200 Antipsychotic agent
DG01940 Butyrophenone derivative
DG00887 Melperone
D08172 Melperone hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D08172 Melperone hydrochloride
Drug groups [BR:br08330]
Neuropsychiatric agent
DG03200 Antipsychotic agent
DG01940 Butyrophenone derivative
DG00887 Melperone
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 20
1 C8x C 18.6900 -18.2700
2 C8y C 18.6900 -19.6700
3 C8x C 19.8800 -20.3700
4 C8x C 21.1400 -19.6700
5 C8y C 21.1400 -18.2700
6 C8x C 19.8800 -17.5700
7 C5a C 22.3300 -17.5700
8 C1b C 23.5900 -18.2700
9 C1b C 24.7800 -17.5700
10 C1b C 25.9700 -18.2700
11 N1y N 27.1600 -17.5700
12 C1x C 28.4200 -18.2700
13 C1x C 29.6100 -17.5700
14 C1y C 29.6100 -16.1700
15 C1x C 28.4200 -15.4700
16 C1x C 27.1600 -16.1700
17 X F 17.5000 -20.3700
18 O5a O 22.3300 -16.1700
19 C1a C 30.8700 -15.4700
20 X Cl 29.9600 -20.7200
BOND 20
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 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 11 16 1
18 2 17 1
19 7 18 2
20 14 19 1
|
|---|
