CHEMBL94015
SMILES | CCCN1COC[C@@H]2c3cc(O)ccc3OC[C@H]21 |
InChIKey | ZFSOBPVEIKTNQS-CHWSQXEVSA-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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.16 | 5.16 | 5.16 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.6 | 8.28 | 8.96 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.6 | 6.3 | 7.38 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |