quinpirole
SMILES | CCCN1CCC[C@H]2[C@H]1Cc1cn[nH]c1C2 |
InChIKey | FTSUPYGMFAPCFZ-ZWNOBZJWSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 219.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 5.8 | 5.8 | 5.8 | Guide to Pharmacology |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.25 | 5.5 | Guide to Pharmacology |
5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.75 | 6.5 | Guide to Pharmacology |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.25 | 5.5 | Guide to Pharmacology |
D2 | DRD2 | Human | Dopamine | A | pKi | 4.9 | 6.3 | 7.7 | Guide to Pharmacology |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.5 | 7.5 | 7.5 | Guide to Pharmacology |
D3 | DRD3 | Rat | Dopamine | A | pKi | 7.3 | 7.55 | 7.8 | Guide to Pharmacology |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.2 | 5.2 | 5.2 | Guide to Pharmacology |
D1 | DRD1 | Pig | Dopamine | A | pKi | 4.06 | 4.1 | 4.14 | ChEMBL |
D2 | DRD2 | Bovine | Dopamine | A | pKi | 5.59 | 6.21 | 7.23 | ChEMBL |
D3 | DRD3 | Rat | Dopamine | A | pKi | 8.25 | 8.25 | 8.25 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKd | 5.17 | 5.5 | 5.72 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.2 | 7.23 | 7.27 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.28 | 8.07 | 8.74 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 4.06 | 5.34 | 7.2 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 4.0 | 4.0 | 4.0 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.38 | 7.56 | 9.39 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 4.51 | 6.59 | 8.26 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.67 | 6.55 | 8.55 | PDSP Ki database |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 5.77 | 5.77 | 5.77 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.37 | 7.76 | 9.07 | PDSP Ki database |
5-HT2A | 5HT2A | Rat | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.91 | 7.87 | 9.64 | PDSP Ki database |
D3 | DRD3 | Rat | Dopamine | A | pKi | 7.33 | 7.71 | 8.29 | PDSP Ki database |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.11 | 6.76 | 8.1 | PDSP Ki database |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
D2 | DRD2 | Mouse | Dopamine | A | pKi | 6.69 | 6.69 | 6.69 | PDSP Ki database |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
D5 | DRD5 | Human | Dopamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 5.6 | 5.6 | 5.6 | PDSP Ki database |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT1B | 5HT1B | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT1D | 5HT1D | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.24 | 5.48 | PDSP Ki database |
5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.76 | 6.52 | PDSP Ki database |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 5.0 | 5.24 | 5.48 | PDSP Ki database |
H1 | HRH1 | Guinea pig | Histamine | A | pKi | 5.98 | 5.98 | 5.98 | PDSP Ki database |
D2 | DRD2 | Dog | Dopamine | A | pKi | 8.32 | 8.32 | 8.32 | PDSP Ki database |
D1 | DRD1 | Rat | Dopamine | A | pKi | 6.0 | 6.0 | 6.0 | PDSP Ki database |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 4.6 | 4.6 | 4.6 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.4 | 7.2 | 8.0 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Rat | Dopamine | A | pEC50 | 7.1 | 7.93 | 8.77 | ChEMBL |
D3 | DRD3 | Rat | Dopamine | A | pIC50 | 7.54 | 7.57 | 7.6 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | Potency | 5.65 | 5.65 | 5.65 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pEC50 | 7.32 | 7.95 | 8.66 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pIC50 | 5.32 | 5.89 | 7.0 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pEC50 | 7.08 | 8.02 | 8.85 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pIC50 | 7.48 | 7.48 | 7.48 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 6.73 | 8.47 | 10.01 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pIC50 | 7.57 | 7.57 | 7.57 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 5.55 | 7.49 | 8.93 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pIC50 | 6.33 | 7.46 | 8.58 | ChEMBL |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 5.2 | 5.2 | 5.2 | ChEMBL |