CHEMBL4740539
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1Cc2cc(O)ccc2CN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)C[C@@H](N)CCCCN)C(C)(C)C)C(=O)O |
| InChIKey | SDIIZGPXYKAMCT-AEYHRTIPSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 8 |
| Rotatable bonds | 20 |
| Molecular weight (Da) | 786.5 |
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 |
| NTS2 | NTR2 | Human | Neurotensin | A | pKi | 8.54 | 8.54 | 8.54 | ChEMBL |
| NTS1 | NTR1 | Human | Neurotensin | A | pKi | 5.42 | 5.42 | 5.42 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |