FENDILINE
| SMILES | CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1 |
| InChIKey | NMKSAYKQLCHXDK-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 1 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 315.2 |
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 |
| 5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 5.49 | 5.49 | 5.49 | ChEMBL |
| 5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pKi | 8.26 | 8.26 | 8.26 | Drug Central |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| CaS | CASR | Human | Calcium-sensing | C | pEC50 | 6.0 | 6.0 | 6.0 | ChEMBL |
| GPR55 | GPR55 | Human | GPR18, GPR55 and GPR119 | A | pIC50 | 5.51 | 5.51 | 5.51 | ChEMBL |
| NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.0 | 5.0 | 5.0 | ChEMBL |
| CaS | CASR | Human | Calcium-sensing | C | pEC50 | 8.22 | 8.22 | 8.22 | Drug Central |
| CaS | CASR | Bovine | Calcium-sensing | C | pEC50 | 8.31 | 8.31 | 8.31 | Drug Central |