CHEMBL5192735
SMILES | CCCC[C@@H](NC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@H](CCCNC(=N)N)C(N)=O |
InChIKey | RKAOARSPWSCJAH-ZGFBMJKBSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 8 |
Rotatable bonds | 18 |
Molecular weight (Da) | 598.3 |
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 |
κ | OPRK | Guinea pig | Opioid | A | pKi | 9.04 | 9.04 | 9.04 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Guinea pig | Opioid | A | pEC50 | 6.02 | 6.02 | 6.02 | ChEMBL |