CHEMBL3310783
| SMILES | N#Cc1c(O)nc(SCc2cccc(F)c2F)nc1C1CC1 |
| InChIKey | PHHZYKZFEBRXAL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 319.1 |
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 |
| M5 | ACM5 | Human | Acetylcholine (muscarinic) | A | pKi | 5.18 | 5.18 | 5.18 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| CX3CR1 | CX3C1 | Human | Chemokine | A | pEC50 | 5.85 | 5.85 | 5.85 | ChEMBL |
| CXCR2 | CXCR2 | Human | Chemokine | A | pIC50 | 6.85 | 7.12 | 7.4 | ChEMBL |