CHEMBL3926078
| SMILES | O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccccc2)c2ccc(Cl)c(F)c2)CC1 |
| InChIKey | JPMFAXPZTPNMRF-QAQDUYKDSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 449.1 |
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 |
| IP | PI2R | Rat | Prostanoid | A | pEC50 | 6.4 | 6.4 | 6.4 | ChEMBL |
| IP | PI2R | Human | Prostanoid | A | pEC50 | 8.47 | 8.52 | 8.57 | ChEMBL |
| IP | PI2R | Human | Prostanoid | A | pIC50 | 7.64 | 7.64 | 7.64 | ChEMBL |
| DP1 | PD2R | Human | Prostanoid | A | pEC50 | 5.69 | 5.69 | 5.69 | ChEMBL |