CHEMBL102331
| SMILES | CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)c3cccnc3)C2)cc1 |
| InChIKey | RDGBZPAYYHGGML-IBGZPJMESA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 367.2 |
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 |
| H3 | HRH3 | Rat | Histamine | A | pKi | 7.43 | 7.43 | 7.43 | ChEMBL |
| H2 | HRH2 | Human | Histamine | A | pKi | 5.46 | 5.46 | 5.46 | ChEMBL |
| H1 | HRH1 | Human | Histamine | A | pKi | 5.13 | 5.13 | 5.13 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |