CHEMBL270394
SMILES | CCC(C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC |
InChIKey | XDTYNZLRQJEAAQ-QABIKYMTSA-N |
Chemical properties
Hydrogen bond acceptors | 11 |
Hydrogen bond donors | 15 |
Rotatable bonds | 32 |
Molecular weight (Da) | 964.6 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 |
NOP | OPRX | Human | Opioid | A | pIC50 | 7.67 | 7.67 | 7.67 | ChEMBL |
NOP | OPRX | Human | Opioid | A | pEC50 | 7.28 | 7.28 | 7.28 | ChEMBL |