RB-400 [6697]
RB-400
| SMILES | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC(=O)O |
| InChIKey | QUSCQANKQSFCGJ-FWEHEUNISA-N |
| Sequence | WXDF |
| HELM | PEPTIDE1{[*C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)CC(=O)O |$_R2;;;;;;;;;;;;;;;;;;;;$|].[*C(=O)[C@H](CCCC)N(*)C |$_R2;;;;;;;;;_R1;$|].D.F.[am]}$$$$ |
Chemical Properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 7 |
| Rotatable bonds | 19 |
| Log P | 0.859 |
| Molecular weight (Da) | 678.3 |
| Stereochemistry info | unspecified |
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 |
RB-400
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