BROMOCRIPTINE,(+)
SMILES | CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O |
InChIKey | OZVBMTJYIDMWIL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 3 |
Rotatable bonds | 5 |
Molecular weight (Da) | 653.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Human | Dopamine | A | pKi | 5.68 | 5.68 | 5.68 | PDSP Ki database |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.09 | 8.09 | 8.09 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.15 | 8.15 | 8.15 | PDSP Ki database |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 7.6 | 7.6 | 7.6 | PDSP Ki database |
5-HT2A | 5HT2A | Rat | 5-Hydroxytryptamine | A | pKi | 6.93 | 6.93 | 6.93 | PDSP Ki database |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 5.33 | 5.33 | 5.33 | PDSP Ki database |
D2 | DRD2 | Bovine | Dopamine | A | pKi | 8.6 | 8.6 | 8.6 | PDSP Ki database |
D1 | DRD1 | Bovine | Dopamine | A | pKi | 6.97 | 6.97 | 6.97 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |