CHEMBL5841133
| SMILES | COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](c2ncc(C)cn2)N2CC(OC)C2)nnc1C1=CC=CN(OC)C1 |
| InChIKey | BUUMKIWEMLWNTP-NTKDMRAZSA-N |
Chemical properties
| Hydrogen bond acceptors | 13 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 12 |
| Molecular weight (Da) | 612.2 |
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 | 9.44 | 9.44 | 9.44 | ChEMBL |