VU0506013
| SMILES | CC1=CC=CC=C1OCC(=O)NC2=CC(=CN(C2=O)C)C(=O)N3CCCC3 |
| InChIKey | HDESYZHTQAEDLX-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 369.2 |
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 |
| Y4 | NPY4R | Human | Neuropeptide Y | A | pKi | 8.36 | 8.36 | 8.36 | ChEMBL |
| Y4 | NPY4R | Human | Neuropeptide Y | A | pKd | 7.51 | 7.51 | 7.51 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| Y4 | NPY4R | Human | Neuropeptide Y | A | pEC50 | 6.9 | 6.9 | 6.9 | Guide to Pharmacology |
| Y4 | NPY4R | Rat | Neuropeptide Y | A | pEC50 | 9.51 | 9.51 | 9.51 | ChEMBL |
| Y4 | NPY4R | Human | Neuropeptide Y | A | pEC50 | 6.9 | 8.1 | 10.51 | ChEMBL |
| Y1 | NPY1R | Human | Neuropeptide Y | A | pEC50 | 10.32 | 10.32 | 10.32 | ChEMBL |
| Y2 | NPY2R | Human | Neuropeptide Y | A | pEC50 | 10.79 | 10.79 | 10.79 | ChEMBL |
| Y5 | NPY5R | Human | Neuropeptide Y | A | pEC50 | 8.73 | 8.73 | 8.73 | ChEMBL |
| Y4 | NPY4R | Mouse | Neuropeptide Y | A | pEC50 | 10.15 | 10.15 | 10.15 | ChEMBL |