CHEMBL1429444
| SMILES | COc1cccc(N2CN(CCc3ccccc3)CN=C2S)c1 |
| InChIKey | JRQWPSDRRXDASL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 327.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/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 | 5.45 | 5.45 | 5.45 | ChEMBL |
| TA1 | TAAR1 | Human | Trace amine | A | pEC50 | 6.12 | 6.12 | 6.12 | ChEMBL |