CHEMBL3360832
| SMILES | N=C(N)NCCC[C@H](N)C(=O)NCC1(Nc2ccccc2)CCN(Cc2ccccc2)CC1 |
| InChIKey | ZMCMZCLBPMDLQR-QFIPXVFZSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 6 |
| Rotatable bonds | 11 |
| Molecular weight (Da) | 451.3 |
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 |
| NPFF1 | NPFF1 | Human | Neuropeptide FF/neuropeptide AF | A | pKi | 6.31 | 6.31 | 6.31 | ChEMBL |
| NPFF2 | NPFF2 | Human | Neuropeptide FF/neuropeptide AF | A | pKi | 5.98 | 5.98 | 5.98 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 7.43 | 7.43 | 7.43 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 8.32 | 8.32 | 8.32 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.47 | 8.47 | 8.47 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |