ICI 174,864 [4040]
ICI 174,864
| SMILES | C=CCN(CC=C)[C@@H](Cc1ccc(O)cc1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O |
| InChIKey | BGJPRBZZLWCLJW-AWCRTANDSA-N |
| Sequence | YXXFL |
| HELM | PEPTIDE1{[*C(=O)[C@H](Cc1ccc(cc1)O)N(CC=C)CC=C |$_R2;;;;;;;;;;;;;;;;;;$|].[Aib].F.L}$$$$ |
Chemical Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 5 |
| Rotatable bonds | 18 |
| Log P | 3.215 |
| Molecular weight (Da) | 606.3 |
| Stereochemistry info | unspecified |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
ICI 174,864
Drug properties
| Molecular type | Peptide |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0