CHEMBL5798934
| SMILES | COc1cnc(N2C[C@@H](O)C[C@@H](S(=O)(=O)Nc3nnc(-c4ccc(C)o4)n3-c3c(OC)cccc3OC)C2)nc1 |
| InChIKey | LWQBNTYOQRFONR-FUHWJXTLSA-N |
Chemical properties
| Hydrogen bond acceptors | 13 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 571.2 |
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 |
| apelin | APJ | Human | Apelin | A | pEC50 | 9.28 | 9.28 | 9.28 | ChEMBL |