CHEMBL4467483
SMILES | COc1ccc2c(c1OC)-c1c(Br)ccc3c1[C@@H](C2)N(C)CC3 |
InChIKey | BEKOHGQOLPINNR-CQSZACIVSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 2 |
Molecular weight (Da) | 373.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Human | Dopamine | A | pEC50 | 6.62 | 6.62 | 6.62 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pIC50 | 4.83 | 5.2 | 5.39 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 7.26 | 7.26 | 7.26 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pIC50 | 7.52 | 8.71 | 9.91 | ChEMBL |