ONO-9054
SMILES | CC(OC(=O)CCC[C@H]1CC[C@H]2[C@@H](OC1)C[C@H]([C@@H]2/C=C/[C@H](COc1cc(F)ccc1F)O)O)C |
InChIKey | BKVUSNOUTQMSBE-XCMGCKIWSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 10 |
Molecular weight (Da) | 482.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FP | PF2R | Human | Prostanoid | A | pKi | 7.77 | 7.77 | 7.77 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
FP | PF2R | Human | Prostanoid | A | pIC50 | 5.52 | 5.52 | 5.52 | Guide to Pharmacology |
FP | PF2R | Human | Prostanoid | A | pEC50 | 5.52 | 5.52 | 5.52 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pEC50 | 8.0 | 8.0 | 8.0 | ChEMBL |