CHEMBL15564
SMILES | CCCN(CCC)CCc1ccc(O)c(O)c1 |
InChIKey | LMYSNFBROWBKMB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 7 |
Molecular weight (Da) | 237.2 |
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 |
D1 | DRD1 | Rat | Dopamine | A | pKi | 5.33 | 5.33 | 5.33 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.65 | 7.65 | 7.65 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.07 | 7.25 | 7.43 | PDSP Ki database |
D2 | DRD2 | Rat | Dopamine | A | pKi | 6.89 | 6.89 | 6.89 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Rat | Dopamine | A | pEC50 | 4.9 | 4.9 | 4.9 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | Potency | 6.3 | 6.3 | 6.3 | ChEMBL |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 4.4 | 4.4 | 4.4 | ChEMBL |