CHEMBL6002724
| SMILES | COc1cnc([C@@H](C)[C@H](C)S(=O)(=O)Nc2nnc(-c3ccccc3Br)n2C2COC(C)(C)OC2)nc1 |
| InChIKey | AHDVACMBWRUGAW-GJZGRUSLSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 580.1 |
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 | 6.04 | 6.04 | 6.04 | ChEMBL |