CHEMBL2365654
SMILES | COc1ccccc1CCn1cnc(-c2ccc(Br)cc2)c1CC(C)C |
InChIKey | DJTRLRPGXLRICP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 7 |
Molecular weight (Da) | 412.1 |
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 |
TA1 | TAAR1 | Human | Trace amine | A | pIC50 | 5.15 | 5.15 | 5.15 | ChEMBL |
TA1 | TAAR1 | Human | Trace amine | A | pEC50 | 5.76 | 5.76 | 5.76 | ChEMBL |