BROMPERIDOL
SMILES | O=C(CCCN1CCC(O)(c2ccc(Br)cc2)CC1)c1ccc(F)cc1 |
InChIKey | RKLNONIVDFXQRX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 419.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Sankey plot
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 6.22 | 6.22 | 6.22 | PDSP Ki database |
D2 | DRD2 | Bovine | Dopamine | A | pKi | 8.85 | 8.85 | 8.85 | PDSP Ki database |
5-HT2A | 5HT2A | Rat | 5-Hydroxytryptamine | A | pKi | 7.59 | 7.59 | 7.59 | PDSP Ki database |
M1 | ACM1 | Human | Acetylcholine (muscarinic) | A | pKi | 5.12 | 5.12 | 5.12 | PDSP Ki database |
M2 | ACM2 | Human | Acetylcholine (muscarinic) | A | pKi | 5.74 | 5.74 | 5.74 | PDSP Ki database |
M4 | ACM4 | Human | Acetylcholine (muscarinic) | A | pKi | 5.77 | 5.77 | 5.77 | PDSP Ki database |
M5 | ACM5 | Human | Acetylcholine (muscarinic) | A | pKi | 5.32 | 5.32 | 5.32 | PDSP Ki database |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.68 | 8.84 | 9.0 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.64 | 9.17 | 9.7 | PDSP Ki database |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.32 | 7.32 | 7.32 | PDSP Ki database |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 7.39 | 7.39 | 7.39 | PDSP Ki database |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 5.3 | 5.3 | 5.3 | PDSP Ki database |
M1 | ACM1 | Human | Acetylcholine (muscarinic) | A | pKi | 8.29 | 8.29 | 8.29 | Drug Central |
M2 | ACM2 | Human | Acetylcholine (muscarinic) | A | pKi | 8.24 | 8.24 | 8.24 | Drug Central |
M3 | ACM3 | Human | Acetylcholine (muscarinic) | A | pKi | 8.29 | 8.29 | 8.29 | Drug Central |
M4 | ACM4 | Human | Acetylcholine (muscarinic) | A | pKi | 8.24 | 8.24 | 8.24 | Drug Central |
M5 | ACM5 | Human | Acetylcholine (muscarinic) | A | pKi | 8.27 | 8.27 | 8.27 | Drug Central |
D1 | DRD1 | Human | Dopamine | A | pKi | 8.15 | 8.15 | 8.15 | Drug Central |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.07 | 8.07 | 8.07 | Drug Central |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.12 | 8.12 | 8.12 | Drug Central |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.11 | 8.11 | 8.11 | Drug Central |
H1 | HRH1 | Human | Histamine | A | pKi | 8.21 | 8.21 | 8.21 | Drug Central |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 5.6 | 5.6 | 5.6 | PDSP Ki database |
M3 | ACM3 | Human | Acetylcholine (muscarinic) | A | pKi | 5.15 | 5.15 | 5.15 | PDSP Ki database |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 8.15 | 8.15 | 8.15 | Drug Central |
M3 | ACM3 | Rat | Acetylcholine (muscarinic) | A | pKi | 5.15 | 5.15 | 5.15 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |