PD 128907
SMILES | CCCN1CCO[C@@H]2[C@@H]1COc1c2cc(cc1)O |
InChIKey | YOILXOMTHPUMRG-JSGCOSHPSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 249.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.4 | 5.9 | 6.4 | Guide to Pharmacology |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.6 | 7.65 | 7.7 | Guide to Pharmacology |
D3 | DRD3 | Human | Dopamine | A | pKd | 9.0 | 9.0 | 9.0 | Guide to Pharmacology |
μ | OPRM | Human | Opioid | A | pKi | 4.11 | 4.11 | 4.11 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.12 | 5.12 | 5.12 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.25 | 5.25 | 5.25 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |