CHEMBL4849630
| SMILES | CSCC[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(N)=O |
| InChIKey | LBSJIZBYRZVTNK-OVPJFHAQSA-N |
Chemical properties
| Hydrogen bond acceptors | 24 |
| Hydrogen bond donors | 23 |
| Rotatable bonds | 49 |
| Molecular weight (Da) | 1426.6 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| FZD2 | FZD2 | Human | Frizzled | F | pIC50 | 10.0 | 10.0 | 10.0 | ChEMBL |
| FZD2 | FZD2 | Rat | Frizzled | F | pIC50 | 10.77 | 10.77 | 10.77 | ChEMBL |
| FZD1 | FZD1 | Rat | Frizzled | F | pIC50 | 8.68 | 8.68 | 8.68 | ChEMBL |
| FZD1 | FZD1 | Human | Frizzled | F | pIC50 | 9.0 | 9.0 | 9.0 | ChEMBL |