CHEMBL24665
| SMILES | NCCc1c[nH]c(-c2cccc(C(F)(F)F)c2)n1 |
| InChIKey | NFUYVKMAGIJYKB-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 255.1 |
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 |
| H3 | HRH3 | Guinea pig | Histamine | A | pKd | 5.21 | 5.21 | 5.21 | ChEMBL |
| H1 | HRH1 | Guinea pig | Histamine | A | pKd | 9.01 | 9.03 | 9.05 | ChEMBL |
| H4 | HRH4 | Human | Histamine | A | pKi | 5.9 | 5.9 | 5.9 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| H4 | HRH4 | Human | Histamine | A | pEC50 | 5.8 | 5.8 | 5.8 | ChEMBL |
| H1 | HRH1 | Human | Histamine | A | pIC50 | 6.0 | 6.0 | 6.0 | ChEMBL |
| H1 | HRH1 | Human | Histamine | A | pEC50 | 6.6 | 6.6 | 6.6 | ChEMBL |