CHEMBL261687
SMILES | O=C(NCCc1ccccc1)C1CCCN(S(=O)(=O)c2cccc3nsnc23)C1 |
InChIKey | WIMGKGMBXJVERQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 430.1 |
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 | 5.66 | 5.66 | 5.66 | ChEMBL |
TA1 | TAAR1 | Human | Trace amine | A | pEC50 | 6.17 | 6.17 | 6.17 | ChEMBL |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 6.8 | 6.8 | 6.8 | ChEMBL |