compound 66 [PMID: 36126387]
| SMILES | C(#C)C1CCN(CC1)C(=O)C2=CN(C(C3=CC(=C(C=C23)OC)OC)=O)C4=CC5=C(SC=C5C)C=C4 |
| InChIKey | KNTSYYKDKFNRKN-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 486.2 |
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 |
| LPA5 | LPAR5 | Human | Lysophospholipid (LPA) | A | pIC50 | 7.5 | 7.5 | 7.5 | Guide to Pharmacology |