RO5101576
| SMILES | OC(=O)CCc1c(CCCCCCOc2cc(cc(c2)c2ccc3c(c2)OCO3)c2ccsc2)cccc1OCCCC(=O)O |
| InChIKey | SRPFDFNVILUDAI-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 18 |
| Molecular weight (Da) | 630.2 |
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 |
| BLT1 | LT4R1 | Human | Leukotriene | A | pIC50 | 8.1 | 8.1 | 8.1 | Guide to Pharmacology |
| BLT2 | LT4R2 | Human | Leukotriene | A | pIC50 | 6.79 | 6.79 | 6.79 | ChEMBL |
| BLT1 | LT4R1 | Human | Leukotriene | A | pIC50 | 6.94 | 8.15 | 9.36 | ChEMBL |