CHEMBL4790994
| SMILES | Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1Cc2ccccc2CN(CCC(=O)N[C@@H](CCCN2CCC(Cc3ccccc3)CC2)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)C1=O |
| InChIKey | FLFNAHDPAHKVGI-ZKUUFLNTSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 10 |
| Rotatable bonds | 25 |
| Molecular weight (Da) | 1013.6 |
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 |
| NPFF1 | NPFF1 | Human | Neuropeptide FF/neuropeptide AF | A | pEC50 | 6.75 | 6.75 | 6.75 | ChEMBL |
| NPFF2 | NPFF2 | Human | Neuropeptide FF/neuropeptide AF | A | pEC50 | 6.8 | 6.8 | 6.8 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pEC50 | 9.11 | 9.11 | 9.11 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pEC50 | 7.02 | 7.02 | 7.02 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 7.75 | 7.75 | 7.75 | ChEMBL |